SCHEMBL5263837

SCHEMBL5263837

COc1ccccc1C(c1cn(C)c2ccccc12)N1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
OPRM1 P35372 2/20 0.46
OPRD1 P41143 2/20 0.46
OPRK1 P41145 2/20 0.46
OPRL1 P41146 2/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
IDO1 P14902 1/20 0.43
P4HB P07237 2/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
POLB P06746 1/20 0.40
TSHR P16473 1/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL5259003 0.80 L3MBTL1 (0.54) L3MBTL1OPRM1MEN1KMT2AALDH1A1
SCHEMBL24302803 0.74 L3MBTL1 (0.51) L3MBTL1MEN1KMT2AALDH1A1HTT
SCHEMBL27493155 0.71 L3MBTL1 (0.61) L3MBTL1MEN1KMT2AALDH1A1HTT
SCHEMBL24302812 0.71 IDO1 (0.60) L3MBTL1MEN1KMT2AALDH1A1HTT
SCHEMBL5385573 0.70 MAPT (0.50) L3MBTL1OPRM1OPRD1OPRK1OPRL1
SCHEMBL12614276 0.69 GPR84 (0.52) MEN1KMT2AALDH1A1NPSR1IDO1
SCHEMBL5260185 0.69 BCL2L11 (0.43) L3MBTL1OPRM1OPRD1OPRK1OPRL1
SCHEMBL5257318 0.69 HSP90AA1 (0.54) L3MBTL1OPRM1MEN1KMT2AALDH1A1
SCHEMBL8963904 0.69 OPRD1 (0.56) OPRM1OPRD1OPRK1OPRL1MEN1
SCHEMBL9257361 0.69 OPRM1 (0.56) OPRM1OPRD1OPRK1OPRL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1261585-B1 SUBSTITUTED INDOLE MANNICH BASES GRUENENTHAL GMBH (DE) 2007-09-26 EP claimed
EP-1261585-B1 SUBSTITUTED INDOLE MANNICH BASES GRUENENTHAL GMBH (DE) 2007-09-26 EP disclosed
EP-1261585-B1 SUBSTITUTED INDOLE MANNICH BASES GRUENENTHAL GMBH (DE) 2007-09-26 EP disclosed
US-7091220-B2 Substituted indole Mannich bases GRUENENTHAL GMBH (DE) 2006-08-15 US disclosed
US-20030060497-A1 Subtituted indole mannich bases GRUENENTHAL GMBH (DE) 2003-03-27 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 (1 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-20030060497-A1 Subtituted indole mannich bases TPH1, IDO1, TPH2 L3MBTL1 2086/4885OPRM1 78/4885OPRD1 38/4885

“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.