SCHEMBL4082808

SCHEMBL4082808

C=C1CC1(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.42
SIGMAR1 Q99720 1/20 0.41
OPRM1 P35372 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
MAOB P27338 8/20 0.38
MAOA P21397 5/20 0.38
MEN1 O00255 1/20 0.37
RGS12 O14924 1/20 0.37
CYP3A4 P08684 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM1A O60341 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
PAX8 Q06710 1/20 0.37
MCL1 Q07820 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL6404032 0.77 OPRM1 (0.41) CCR2SIGMAR1OPRM1OPRK1OPRL1
SCHEMBL4095120 0.74 MAOB (0.41) OPRM1OPRK1OPRL1MAOBMAOA
SCHEMBL24581639 0.72 CHRNB2 (0.35) CCR2SIGMAR1OPRL1
SCHEMBL498014 0.70 OPRM1 (0.50) OPRM1OPRK1OPRL1MAOBMAOA
SCHEMBL23795268 0.70 MEN1 (0.50) CCR2SIGMAR1OPRM1OPRK1OPRL1
SCHEMBL16837172 0.69 CHRNB4 (0.39) CCR2SIGMAR1OPRM1MAOAKDM1A
Ammonia Solution, Strong SCHEMBL9556021 0.69 OPRM1 (0.48) OPRM1OPRK1OPRL1MAOBMAOA
SCHEMBL1568276 0.67 CYP19A1 (0.68) CCR2OPRM1OPRL1MEN1KMT2A
SCHEMBL353050 0.67 OPRL1 (0.46) OPRM1OPRK1OPRL1
SCHEMBL43078 0.67 DPP4 (0.46) OPRM1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100512582-C Light emitting system, light emitting method and chemical substance for light emission HITACHI CHEMICAL CO LTD (JP) 2009-07-08 CN disclosed
US-20090163743-A1 LUMINESCENCE SYSTEM, METHOD OF LUMINESCENCE, AND CHEMICAL SUBSTANCE FOR LUMINESCENCE HOSHI YOUSUKE 2009-06-25 US disclosed
US-20070138945-A1 Luminescence system, method of luminescence, and chemical substance for luminescence HITACHI CHIEMICAL CO., LTD., (JP) 2007-06-21 US 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-20070138945-A1 Luminescence system, method of luminescence, and chemical substance for luminescence GLO1, TYR, GUSB CCR2 2492/4885SIGMAR1 1169/4885OPRM1 1288/4885
US-20090163743-A1 LUMINESCENCE SYSTEM, METHOD OF LUMINESCENCE, AND CHEMICAL SUBSTANCE FOR LUMINESCENCE GLO1, TYR, GUSB CCR2 2492/4885SIGMAR1 1169/4885OPRM1 1288/4885

“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.