SCHEMBL1003282

SCHEMBL1003282

CCCC(C)NC(=O)c1ccccc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.82
NPC1 O15118 2/20 0.82
ALDH1A1 P00352 3/20 0.71
HPGD P15428 2/20 0.71
SMN1; SMN2 Q16637 4/20 0.69
LMNA P02545 2/20 0.69
KMT2A Q03164 3/20 0.66
MEN1 O00255 2/20 0.66
HTT P42858 1/20 0.66
POLB P06746 1/20 0.61
NAMPT P43490 1/20 0.58
HSP90AA1 P07900 1/20 0.57
PRSS1 P07477 1/20 0.56
CTSG P08311 1/20 0.56
CTRB1 P17538 1/20 0.56
CMA1 P23946 1/20 0.56
TAS1R3 Q7RTX0 1/20 0.54
TAS1R1 Q7RTX1 1/20 0.54
MLYCD O95822 1/20 0.52
KDM4E B2RXH2 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12706065 0.90 RAB9A (1.00) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL12366268 0.90 RAB9A (1.00) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL27452233 0.90 RAB9A (0.68) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL5332053 0.88 MLYCD (0.68) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL28243626 0.86 HPGD (0.71) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL28243627 0.86 HPGD (0.71) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL25280005 0.85 MLYCD (0.64) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL8526512 0.85 RAB9A (0.87) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL8507346 0.85 RAB9A (0.87) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2
SCHEMBL799431 0.85 RAB9A (0.87) RAB9ANPC1ALDH1A1HPGDSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746120-B2 Stat degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-09-05 US disclosed
CN-113372568-B Preparation method of neodymium-based or holmium-based chiral metal-organic porous crystalline material, prepared material and application thereof 合肥工业大学 2022-07-22 CN disclosed
CN-113372568-A Preparation method of neodymium-based or holmium-based chiral metal-organic porous crystalline material, prepared material and application thereof 合肥工业大学 2021-09-10 CN disclosed
US-10654845-B2 2-(het)aryl-substituted fused bicyclic heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-05-19 US disclosed
CN-106062013-B Catalyst composition for olefin polymerization 沙特基础工业公司 2019-07-16 CN disclosed
US-20180016273-A1 2-(HET)ARYL-SUBSTITUTED FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-01-18 US disclosed
US-9546153-B2 Bicyclic heterocycle substituted pyridyl compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2017-01-17 US disclosed
EP-2922840-B1 BICYCLIC HETEROCYCLE SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL MYERS SQUIBB CO (US) 2016-12-21 EP disclosed
US-20150274696-A1 BICYCLIC HETEROCYCLE SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2015-10-01 US disclosed
US-8778219-B2 Ionic liquids for separation of olefin-paraffin mixtures UT-BATTELLE, LLC (US) 2014-07-15 US disclosed
US-6413979-B1 ANTAGONISTS TO ENDOTHELINS; VASODILATORS AND BRONCHODILATORS; SYNTHESIS ROUTES; HYPERTENSION, ASTHMA, RAYNAUD'S DISEASE, RENAL AND HEART FAILURE, ANGINA, DIABETES, CEREBRAL INFARC-TION AND VASOSPASM, ARTERIOSCLEROSIS, RESTENOSIS, PROSTATISM BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-02 US disclosed
US-6380195-B1 INCLUDING (METHYLENEDIOXYPHENYL)CYCLOPENTENO(1,2-B)PYRIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-04-30 US disclosed
EP-1179525-A1 Process for the preparation of carboxylic acid amides by oxidation of aldehydes in the presence of amines Degussa Aktiengesellschaft (DE) 2002-02-13 EP disclosed
EP-0714897-B1 FUSED HETEROAROMATIC CYCLOPENTENE DERIVATIVE HAVING ENDOTHELIN-ANTAGONIST ACTIVITY BANYU PHARMA CO LTD (JP) 2001-02-14 EP disclosed
EP-1049691-A1 SUBSTITUTED 5-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL) CYCLOPENTENOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-11-08 EP disclosed
US-6087360-A TREATING PATIENTS WITH ENDOTHELIN RELATED DISORDERS BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-07-11 US disclosed
WO-1999037639-A1 SUBSTITUTED 5-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL) CYCLOPENTENOPYRIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-07-29 WO disclosed
US-5834483-A Method of treating heart failure with endothelin antagonists MERCK & CO., INC. (US) 1998-11-10 US disclosed
US-5714479-A TREATMENT OF HYPERTENSION, ACUTE RENAL FAILURE, ANGINA PECTORIS, ARTERIOSCLEROSIS, ASTHMA, GASTRIC ULCER AND SIMILAR AILMENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-02-03 US disclosed
EP-0714897-A1 FUSED HETEROAROMATIC CYCLOPENTENE DERIVATIVE HAVING ENDOTHELIN-ANTAGONIST ACTIVITY BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-06-05 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180016273-A1 2-(HET)ARYL-SUBSTITUTED FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES CYP4B1, CYP1B1, CYP8B1 RAB9A 751/4885NPC1 2598/4885ALDH1A1 363/4885
US-20150274696-A1 BICYCLIC HETEROCYCLE SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS IRAK4, IRAK1, IRAK3 RAB9A 2555/4885NPC1 3964/4885ALDH1A1 3540/4885
US-10654845-B2 2-(het)aryl-substituted fused bicyclic heterocycle derivatives as pesticides CYP4B1, CYP1B1, CYP8B1 RAB9A 802/4885NPC1 2651/4885ALDH1A1 380/4885
US-11746120-B2 Stat degraders and uses thereof STAT4, STAT1, STAT3 RAB9A 3984/4885NPC1 4238/4885ALDH1A1 2465/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.