SCHEMBL4869840

SCHEMBL4869840

CCOC(=O)C1=CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
GABRR1 P24046 2/20 0.56
GABRP O00591 1/20 0.56
GABRD O14764 1/20 0.56
GABRA1 P14867 1/20 0.56
GABRB1 P18505 1/20 0.56
GABRG2 P18507 1/20 0.56
GABRB3 P28472 1/20 0.56
GABRA5 P31644 1/20 0.56
GABRA3 P34903 1/20 0.56
GABRA2 P47869 1/20 0.56
GABRB2 P47870 1/20 0.56
GABRA4 P48169 1/20 0.56
GABRE P78334 1/20 0.56
GABRA6 Q16445 1/20 0.56
GABRG1 Q8N1C3 1/20 0.56
GABRG3 Q99928 1/20 0.56
GABRQ Q9UN88 1/20 0.56
BLM P54132 2/20 0.55
LMNA P02545 2/20 0.55

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
SCHEMBL11558516 0.88 TSHR (0.51) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL11559988 0.85 TSHR (0.49) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL11559857 0.85 TSHR (0.49) TSHRGABRR1GABRPGABRDGABRA1
Bromide SCHEMBL11562528 0.84 TSHR (0.47) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL16731027 0.84 CHRM3 (0.49) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL12659213 0.84 CHRM3 (0.43) TSHRLMNAMEN1KMT2AKDM4E
SCHEMBL11559808 0.83 TSHR (0.50) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL11560519 0.83 TSHR (0.50) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL11553783 0.83 TSHR (0.46) TSHRGABRR1GABRPGABRDGABRA1
SCHEMBL11559876 0.82 TSHR (0.45) TSHRGABRR1GABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116724038-A Bicyclic compounds 安力高医药股份有限公司 2023-09-08 CN disclosed
EP-3398598-B1 SULFONAMIDE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF HITGEN INC (CN) 2022-04-06 EP disclosed
EP-3398598-B1 SULFONAMIDE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF HITGEN INC (CN) 2022-04-06 EP disclosed
US-11149008-B2 Sulfamide derivatives and preparation method and use thereof HitGen, Inc. 2021-10-19 US disclosed
US-11149008-B2 Sulfamide derivatives and preparation method and use thereof HitGen, Inc. 2021-10-19 US disclosed
CN-106928198-B Sulfonamide derivative and preparation method and application thereof 成都先导药物开发股份有限公司 2020-07-28 CN disclosed
US-20190031612-A1 SULFAMIDE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF HITGEN LTD. (CN) 2019-01-31 US disclosed
US-20190031612-A1 SULFAMIDE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF HITGEN LTD. (CN) 2019-01-31 US disclosed
EP-3398598-A1 SULFONAMIDE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF Hitgen Ltd. (CN) 2018-11-07 EP disclosed
EP-3257848-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING EGFR ACTIVITY Novartis AG (CH) 2017-12-20 EP disclosed
US-20080153809-A1 NOVEL AMIDES USEFUL FOR TREATING PAIN ABBOTT LABORATORIES (US) 2008-06-26 US disclosed
US-7348343-B2 Amides useful for treating pain ABBOTT LABORATORIES INC. (US) 2008-03-25 US disclosed
US-20070010557-A1 Novel amides useful for treating pain ABBVIE INC. 2007-01-11 US disclosed
US-7129235-B2 Amides useful for treating pain ABBOTT LABORATORIES (US) 2006-10-31 US disclosed
US-6977262-B2 Dihydropyrazolopyridine compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2005-12-20 US disclosed
EP-1537106-A1 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS Mitsubishi Pharma Corporation (JP) 2005-06-08 EP disclosed
US-20050080095-A1 administering a therapeuitcally effective amount of 3'-(trifluoromethyl)-N-{4-[(trifluoromethyl)sulfonyl]phenyl}-3,6-dihydro-2H-1,2'-bipyridine-4-carboxamide; antagonists of vanilloid receptor subtype I ABBVIE INC. 2005-04-14 US disclosed
US-20050009841-A1 Novel amides useful for treating pain ABBOTT LABORATORIES 2005-01-13 US disclosed
US-20040052822-A1 Dihydropyrazolopyridine compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-03-18 US disclosed
WO-2004014910-A1 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS MITSUBISHI PHARMA CORPORATION (JP) 2004-02-19 WO 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 (7 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-20050009841-A1 Novel amides useful for treating pain OPRL1, OPRK1, FAAH2 TSHR 3277/4885GABRR1 326/4885GABRP 538/4885
US-20050080095-A1 administering a therapeuitcally effective amount of 3'-(trifluoromethyl)-N-{4-[(trifluoromethyl)sulfonyl]phenyl}-3,6-dihydro-2H-1,2'-bipyridine-4-carboxamide; antagonists of vanilloid receptor subtype I TRPV1, OPRL1, TRPV6 TSHR 397/4885GABRR1 784/4885GABRP 443/4885
US-11149008-B2 Sulfamide derivatives and preparation method and use thereof HDAC6, HDAC1, HDAC11 TSHR 2376/4885GABRR1 3082/4885GABRP 3302/4885
US-20040052822-A1 Dihydropyrazolopyridine compounds and pharmaceutical use thereof GSK3B, GSK3A, PYGB TSHR 4767/4885GABRR1 2969/4885GABRP 2387/4885
US-20070010557-A1 Novel amides useful for treating pain OPRL1, PDE6B, PDE6G TSHR 717/4885GABRR1 1559/4885GABRP 1727/4885
US-20080153809-A1 NOVEL AMIDES USEFUL FOR TREATING PAIN OPRL1, OPRK1, OPRD1 TSHR 1641/4885GABRR1 965/4885GABRP 1359/4885
US-20190031612-A1 SULFAMIDE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF HDAC6, HDAC1, HDAC11 TSHR 2376/4885GABRR1 3082/4885GABRP 3302/4885

“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.