SCHEMBL863136

SCHEMBL863136

CC(=O)NCCc1cccs1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.66
RAB9A P51151 5/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
TAAR1 Q96RJ0 2/20 0.59
ADAM17 P78536 5/20 0.57
LMNA P02545 1/20 0.55
HSD11B1 P28845 1/20 0.55
BRD4 O60885 1/20 0.55
ALDH1A1 P00352 2/20 0.53
MAPT P10636 1/20 0.53
POLB P06746 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CASP3 P42574 1/20 0.50
CASP7 P55210 1/20 0.50
HPGD P15428 2/20 0.49

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
SCHEMBL2731878 0.84 NPC1 (0.68) NPC1RAB9ASMN1; SMN2TAAR1ADAM17
SCHEMBL5251770 0.83 NPC1 (0.62) NPC1RAB9ASMN1; SMN2TAAR1ADAM17
SCHEMBL4031932 0.82 POLB (0.69) NPC1RAB9ASMN1; SMN2TAAR1ADAM17
SCHEMBL885325 0.81 POLB (0.68) RAB9ASMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL6077138 0.81 LMNA (0.65) NPC1RAB9ASMN1; SMN2LMNAALDH1A1
SCHEMBL7904577 0.81 ADAM17 (0.64) NPC1RAB9ASMN1; SMN2TAAR1ADAM17
SCHEMBL3322924 0.81 NPC1 (0.60) NPC1RAB9ASMN1; SMN2TAAR1ADAM17
SCHEMBL26333613 0.81 NPC1 (0.60) NPC1RAB9ASMN1; SMN2TAAR1ADAM17
SCHEMBL28872246 0.81 NPC1 (0.64) NPC1RAB9ASMN1; SMN2TAAR1ADAM17
SCHEMBL11842516 0.80 NPC1 (0.59) NPC1RAB9ASMN1; SMN2TAAR1ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115484933-A Hot melt extrusion solid dispersions containing BCL2 inhibitors 广州麓鹏制药有限公司 2022-12-16 CN disclosed
US-9856254-B2 Alkoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-01-02 US disclosed
US-20160280707-A1 ALKOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2016-09-29 US disclosed
US-20160280707-A1 ALKOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2016-09-29 US disclosed
US-9365567-B2 Alkoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-06-14 US disclosed
US-9365567-B2 Alkoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2016-06-14 US disclosed
EP-1696912-B1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2016-05-11 EP disclosed
US-9315454-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-04-19 US disclosed
WO-2016012333-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-01-28 WO disclosed
US-9145410-B2 Pyrazolopyridines and analogs thereof 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-09-29 US disclosed
US-4839365-A Thienopyridine derivatives useful in treating gastric ulcers SHINOGI & CO., LTD. (JP) 1989-06-13 US disclosed
EP-0292051-A2 Thienopyridine derivatives SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1988-11-23 EP disclosed
EP-0262395-A2 Sulfonamido-ethyl compounds, medicines containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1988-04-06 EP disclosed
US-4517124-A REACTION OF A MERCAPTAN TO FORM ANTIVIOTIC BEECHAM GROUP LIMITED (GB) 1985-05-14 US disclosed
EP-0046363-B1 PROCESS FOR THE PREPARATION OF 2-THIO PENEM DERIVATIVES AND INTERMEDIATES THEREFOR BEECHAM GROUP PLC (GB) 1984-11-14 EP disclosed
EP-0005348-B1 CARBAPENEM DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1982-09-22 EP disclosed
EP-0046363-A1 Process for the preparation of 2-thio penem derivatives and intermediates therefor BEECHAM GROUP PLC (GB) 1982-02-24 EP disclosed
US-4278686-A ANTIBIOTICS BEECHAM GROUP LIMITED (GB) 1981-07-14 US disclosed
EP-0005349-A1 Alkylcarbapenems, their preparation, use in pharmaceutical compositions and intermediates BEECHAM GROUP PLC (GB) 1979-11-14 EP disclosed
EP-0005348-A1 Carbapenem derivatives, a process for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1979-11-14 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 (1 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-20160280707-A1 ALKOXY SUBSTITUTED IMIDAZOQUINOLINES IL2, IFNG, IRF3 NPC1 2931/4885RAB9A 1342/4885SMN1; SMN2 3463/4885

“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.