SCHEMBL8521342

SCHEMBL8521342

C=C(c1cccc(CCl)c1)c1ccc2ccccc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 4/20 0.44
▸ MAPT P10636 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ MGAM O43451 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ RAB9A P51151 2/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ TMEM97 Q5BJF2 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ POLB P06746 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
SCHEMBL27337695 0.83 CNR2 (0.44) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL28605670 0.78 CNR2 (0.62) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL8746411 0.78 CNR2 (0.47) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL9335423 0.76 PRSS1 (0.38) CNR2MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL9335143 0.75 CNR2 (0.48) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL28443611 0.75 MGAM (0.61) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL3860500 0.74 HSD17B14 (0.52) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL22501419 0.71 RAB9A (0.50) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL9757049 0.70 NR4A2 (0.41) CNR2MAPTKDM4EALDH1A1GAA
SCHEMBL27347786 0.70 CNR2 (0.36) CNR2NPC1

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-0469833-B1 N-Benzyl-Indoles, processes for their preparation and pharmaceutical compositions containing them LILLY CO ELI (GB) 1999-09-08 — — EP disclosed
US-5622969-A ADMINISTERING TO HUMAN OR ANIMAL SUFFERING FROM ALLERGIC REACTION OF PULMONARY SYSTEM AND OTHER INFLAMMATORY DISORDERS ELI LILLY AND COMPANY (US) 1997-04-22 — — US disclosed
US-5569764-A USEFUL FOR TREATING ALLERGIC REACTIONS OF PULMONARY SYSTEM, ALLERGIC SKIN DISEASES, RHEUMATIC FEVER, CYSTIC FIBROSIS, AND VASCULAR DISEASES ELI LILLY AND COMPANY (US) 1996-10-29 — — US disclosed
US-5486612-A FOR TREATING DISEASES WHICH LEUKOTRIENES MEDIATE ELI LILLY AND COMPANY (US) 1996-01-23 — — US disclosed
EP-0658554-A1 N-benzyl dihydroindole LTD4 antagonists ELI LILLY AND COMPANY (US) 1995-06-21 — — EP disclosed
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