SCHEMBL1690233

SCHEMBL1690233

CC(C)(C)OC(=O)C1CCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.49
BTK Q06187 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.43
KMT2A Q03164 3/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HPGD P15428 1/20 0.41
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
MAPK1 P28482 1/20 0.38
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
CHRM2 P08172 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37
ATM Q13315 1/20 0.37
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL1764699 0.95 HRH3 (0.49) HRH3BTKSMN1; SMN2KMT2AHTT
SCHEMBL28655866 0.93 HRH3 (0.47) HRH3BTKSMN1; SMN2KMT2AHTT
SCHEMBL1409272 0.93 HRH3 (0.47) HRH3BTKSMN1; SMN2KMT2AHTT
SCHEMBL28172293 0.93 HRH3 (0.47) HRH3BTKSMN1; SMN2KMT2AHTT
Hydrochloric Acid SCHEMBL27793145 0.93 HRH3 (0.47) HRH3BTKSMN1; SMN2KMT2AHTT
SCHEMBL31356450 0.93 HRH3 (0.47) HRH3BTKSMN1; SMN2KMT2AHTT
SCHEMBL11752523 0.93 HRH3 (0.47) HRH3BTKSMN1; SMN2KMT2AHTT
Formic Acid SCHEMBL28215972 0.92 HRH3 (0.44) HRH3BTKSMN1; SMN2KMT2AHTT
SCHEMBL25762342 0.91 BTK (0.50) HRH3BTKSMN1; SMN2KMT2AHTT
SCHEMBL1296378 0.91 BTK (0.50) HRH3BTKSMN1; SMN2KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536623-A Synthetic method of 3-cyclotetramethylene benzofuran derivative 南通大学 2022-12-30 CN claimed
CN-105294546-B A kind of pyridine compounds and preparation method thereof 天津市斯芬克司药物研发有限公司 2017-12-08 CN claimed
CN-112189010-B Triazole N-linked carbamoyl cyclohexyl acid as LPA antagonists 百时美施贵宝公司 2026-05-15 CN disclosed
US-12304913-B2 Dihydropyrrolopyrazole derivative UBE INDUSTRIES, LTD. (JP) 2025-05-20 US disclosed
US-12209072-B2 Cyclopentyl acids as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2025-01-28 US disclosed
US-12195444-B2 Triazole n-linked carbamoyl cyclohexyl acids as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2025-01-14 US disclosed
US-20240400561-A1 NOVEL SUBSTITUTED SULFONYLUREA COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2024-12-05 US disclosed
CN-118955473-A Difunctional compounds for degrading BTK via the ubiquitin proteasome pathway 紐力克斯治疗公司 2024-11-15 CN disclosed
US-20240317686-A1 RORyT MODULATOR, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2024-09-26 US disclosed
EP-4408843-A1 NOVEL SUBSTITUTED SULFONYLUREA COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY Viva Star Biosciences (Suzhou) Co., Ltd. (CN) 2024-08-07 EP disclosed
CN-113412259-B Difunctional compounds for degrading BTK via the ubiquitin proteasome pathway 紐力克斯治疗公司 2024-07-16 CN disclosed
US-20110190255-A1 HETEROCYCLIC COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2011-08-04 US disclosed
WO-2011071570-A1 NOVEL OXADIAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-16 WO disclosed
WO-2011071570-A1 NOVEL OXADIAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-16 WO disclosed
CN-101801376-A Pyrazolo (3,4-b) pyridine derivatives as phosphodiesterase inhibitors RANBAXY LAB LTD 2010-08-11 CN disclosed
US-20090018184-A1 Polyether Brevetoxin Derivatives as a Treatment for Cystic Fibrosis, Mucociliary Dysfunction, and Pulmonary Diseases UNIVERSITY OF NORTH CAROLINA AT WILMINGTON 2009-01-15 US disclosed
CN-101321738-A Spirocyclic derivatives PFIZER LTD (GB) 2008-12-10 CN disclosed
US-7399782-B2 Polyether brevetoxin derivatives as a treatment for cystic fibrosis, mucociliary dysfunction, and pulmonary diseases UNIVERSITY OF NORTH CAROLINA AT WILMINGTON (US) 2008-07-15 US disclosed
US-20070036258-A1 Process for producing radioactive fluorine compound NIHON MEDI-PHYSICS CO., LTD. (JP) 2007-02-15 US disclosed
CN-1419541-A Pharmaceutically active pyrrolidine derivatives as BAX inhibitors APPLIED RES SYSTEMS AKS HOLDIN (NL) 2003-05-21 CN 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 (8 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-20240400561-A1 NOVEL SUBSTITUTED SULFONYLUREA COMPOUNDS AS INHIBITORS OF INTERLEUKIN-1 ACTIVITY IL1B, IL1A, IL18 HRH3 3423/4885BTK 3278/4885SMN1; SMN2 2104/4885
US-12209072-B2 Cyclopentyl acids as LPA antagonists LPAR1, LPAR5, LPAR2 HRH3 873/4885BTK 3029/4885SMN1; SMN2 4240/4885
US-20090018184-A1 Polyether Brevetoxin Derivatives as a Treatment for Cystic Fibrosis, Mucociliary Dysfunction, and Pulmonary Diseases CFTR, MUC1, SLC47A1 HRH3 2493/4885BTK 2554/4885SMN1; SMN2 3290/4885
US-20110190255-A1 HETEROCYCLIC COMPOUNDS S1PR1, S1PR3, S1PR5 HRH3 50/4885BTK 934/4885SMN1; SMN2 1771/4885
US-12304913-B2 Dihydropyrrolopyrazole derivative CBR3, SLC13A3, CYP3A5 HRH3 363/4885BTK 2594/4885SMN1; SMN2 3368/4885
US-20240317686-A1 RORyT MODULATOR, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF RORC, RORB, RORA HRH3 2047/4885BTK 1910/4885SMN1; SMN2 4471/4885
US-20070036258-A1 Process for producing radioactive fluorine compound AFF1, AFF4, RER1 HRH3 236/4885BTK 2358/4885SMN1; SMN2 1776/4885
US-12195444-B2 Triazole n-linked carbamoyl cyclohexyl acids as LPA antagonists LPAR3, LPAR1, LPAR2 HRH3 207/4885BTK 1782/4885SMN1; SMN2 4482/4885

“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.