SCHEMBL19635882

SCHEMBL19635882

c1ccc(COC2CCC3(CC3)N(Cc3ccccc3)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.51
OPRL1 P41146 2/20 0.51
DPP4 P27487 1/20 0.51
CTSL P07711 2/20 0.46
CTSB P07858 2/20 0.46
CTSK P43235 2/20 0.46
NAAA Q02083 4/20 0.41
SIGMAR1 Q99720 3/20 0.41
TMEM97 Q5BJF2 1/20 0.40
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40
PRMT8 Q9NR22 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
CTSV O60911 1/20 0.39
CTSS P25774 1/20 0.39
CTSC P53634 1/20 0.39

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
SCHEMBL19214942 0.87 CTSL (0.47) OPRM1OPRL1DPP4CTSLCTSB
SCHEMBL21598847 0.84 OPRM1 (0.53) OPRM1OPRL1DPP4CTSLCTSB
SCHEMBL19635880 0.83 OPRM1 (0.38) OPRM1OPRL1DPP4SIGMAR1ALDH1A1
SCHEMBL27090796 0.79 CARM1 (0.45) OPRM1OPRL1DPP4CTSLCTSB
SCHEMBL24652674 0.73 NPC1 (0.58) CTSLCTSBCTSKNAAASIGMAR1
SCHEMBL25399688 0.72 CTSL (0.56) DPP4CTSLCTSBCTSKALDH1A1
SCHEMBL11226960 0.72 CTSL (0.60) CTSLCTSBCTSKNAAASIGMAR1
SCHEMBL19181061 0.71 CTSL (0.43) OPRM1OPRL1DPP4CTSLCTSB
SCHEMBL19779511 0.71 ALDH1A1 (0.63) SIGMAR1TMEM97CYP2C19ALDH1A1LMNA
SCHEMBL28187918 0.71 ALDH1A1 (0.63) SIGMAR1TMEM97CYP2C19ALDH1A1LMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3708165-B1 CRYSTAL FORM I OF A 5-AMINOPYRAZOLE CARBOXAMIDE COMPOUND AS BTK INHIBITOR SINOMAB BIOSCIENCE LTD (CN) 2023-01-18 EP disclosed
EP-3459940-B1 5-AMINOPYRAZOLE CARBOXAMIDE DERIVATIVE AS BTK INHIBITOR AND PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF SUZHOU SINOVENT PHARMACEUTICALS CO LTD (CN) 2022-07-20 EP disclosed
US-11180475-B2 Crystal form I of a 5-aminopyrazole carboxamide compound as BTK inhibitor SINOMAB BIOSCIENCE LIMITED (HK) 2021-11-23 US disclosed
US-10882843-B2 5-aminopyrazole carboxamide derivative as BTK inhibitor and preparation method and pharmaceutical composition thereof Suzhou Sinovent Pharmaceuticals Co., Ltd. (CN) 2021-01-05 US disclosed
US-20200361902-A1 CRYSTAL FORM I OF A 5-AMINOPYRAZOLE CARBOXAMIDE COMPOUND AS BTK INHIBITOR SUZHOU SINOVENT PHARMA CO., LTD. (CN) 2020-11-19 US disclosed
EP-3708165-A1 CRYSTAL FORM I OF A 5-AMINOPYRAZOLE CARBOXAMIDE COMPOUND AS BTK INHIBITOR Sinomab Bioscience Limited (CN) 2020-09-16 EP disclosed
US-20190152952-A1 5-AMINOPYRAZOLE CARBOXAMIDE DERIVATIVE AS BTK INHIBITOR AND PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF Evopoint Biosciences Co., Ltd. (CN) 2019-05-23 US disclosed
EP-3459940-A1 5-AMINOPYRAZOLE CARBOXAMIDE DERIVATIVE AS BTK INHIBITOR AND PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF Zhejiang Yukon Pharma Co., Ltd. (CN) 2019-03-27 EP disclosed
WO-2017198049-A1 PYRAZOLOPYRIMIDINE DERIVATIVE AS BTK INHIBITOR AND PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF 浙江予川医药科技有限公司 2017-11-23 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 (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-10882843-B2 5-aminopyrazole carboxamide derivative as BTK inhibitor and preparation method and pharmaceutical composition thereof BTK, SYK, LCK OPRM1 4181/4885OPRL1 2730/4885DPP4 950/4885
US-20200361902-A1 CRYSTAL FORM I OF A 5-AMINOPYRAZOLE CARBOXAMIDE COMPOUND AS BTK INHIBITOR BTK, SYK, LCK OPRM1 4512/4885OPRL1 3650/4885DPP4 2726/4885
US-11180475-B2 Crystal form I of a 5-aminopyrazole carboxamide compound as BTK inhibitor BTK, SYK, LCK OPRM1 4512/4885OPRL1 3650/4885DPP4 2726/4885
US-20190152952-A1 5-AMINOPYRAZOLE CARBOXAMIDE DERIVATIVE AS BTK INHIBITOR AND PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF BTK, SYK, LCK OPRM1 4181/4885OPRL1 2730/4885DPP4 950/4885

“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.