SCHEMBL7355415

SCHEMBL7355415

N#CC1(c2ccccc2)CC=CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.51
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
OPRL1 P41146 4/20 0.43
OPRD1 P41143 1/20 0.42
HDAC4 P56524 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CA7 P43166 1/20 0.36
CA14 Q9ULX7 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
SCHEMBL432561 0.81 OPRM1 (0.59) OPRM1CA12CA1CA2CA9
SCHEMBL1366600 0.78 OPRM1 (0.53) OPRM1CA12CA1CA2CA9
SCHEMBL13163462 0.78 OPRM1 (0.36) OPRM1
SCHEMBL31417097 0.78 OPRM1 (0.34) OPRM1
SCHEMBL3888335 0.78 OPRM1 (0.53) OPRM1CA12CA1CA2CA9
SCHEMBL1558872 0.78 MAOB (0.36) OPRM1NPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL56575 0.77 NPC1 (0.57) OPRM1CA12CA1CA2CA9
SCHEMBL872608 0.77 OPRM1 (0.56) OPRM1CA12CA1CA2CA9
SCHEMBL31417072 0.77 HSD11B1 (0.38) OPRM1KMT2AALDH1A1SMN1; SMN2
SCHEMBL14101119 0.77 HSD11B1 (0.38) OPRM1KMT2AALDH1A1SMN1; 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084087-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS INCYTE CORPORATION 2025-03-13 US disclosed
WO-2025042730-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS INCYTE CORPORATION (US) 2025-02-27 WO disclosed
US-20100234409-A1 Amino cyclopentyl heterocyclic and carbocyclic modulators of chemokine receptor activity MERCK SHARP & DOHME CORP. 2010-09-16 US disclosed
US-7514431-B2 Piperidinyl cyclopentyl aryl benzylamide modulators of chemokine receptor activity MERCK & CO., INC. (US) 2009-04-07 US disclosed
US-7514431-B2 Piperidinyl cyclopentyl aryl benzylamide modulators of chemokine receptor activity MERCK & CO., INC. (US) 2009-04-07 US disclosed
US-7494986-B2 Cycloalkylamine derivatives as NK-1/SSRI antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2009-02-24 US disclosed
EP-0655057-B1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS UPJOHN CO (US) 1997-09-17 EP disclosed
US-5567722-A DIURETICS THE UPJOHN COMPANY (US) 1996-10-22 US disclosed
EP-0655057-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS. UPJOHN CO (US) 1995-05-31 EP disclosed
WO-1994004500-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS THE UPJOHN COMPANY (US) 1994-03-03 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 (2 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-20100234409-A1 Amino cyclopentyl heterocyclic and carbocyclic modulators of chemokine receptor activity CXCR3, CXCR1, CCR2 OPRM1 1169/4885CA12 2548/4885CA1 1722/4885
US-20250084087-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS MRGPRX2, MRGPRX1, MRGPRX4 OPRM1 386/4885CA12 4677/4885CA1 4518/4885

“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.