SCHEMBL9656221

SCHEMBL9656221

Cc1occc1C(=O)Nc1cccc2c1CCC2(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.59
▸ ESR2 Q92731 1/20 0.59
▸ SMN1; SMN2 Q16637 7/20 0.55
▸ NPC1 O15118 6/20 0.55
▸ RAB9A P51151 6/20 0.55
▸ TP53 P04637 4/20 0.55
▸ ALDH1A1 P00352 4/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ GAA P10253 2/20 0.55
▸ NFKB1 P19838 2/20 0.55
▸ NFKB2 Q00653 2/20 0.55
▸ RELA Q04206 2/20 0.55
▸ POLB P06746 3/20 0.48
▸ HSD17B10 Q99714 5/20 0.46
▸ HTT P42858 3/20 0.46
▸ PKM P14618 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ TSHR P16473 1/20 0.44

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
SCHEMBL9655884 0.82 MAPT (0.52) MAPK1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL10940140 0.81 L3MBTL1 (0.47) MAPK1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL9656306 0.77 MAPK1 (0.56) MAPK1ESR2SMN1; SMN2NPC1RAB9A
SCHEMBL10340948 0.77 ATM (0.57) SMN1; SMN2NPC1RAB9AALDH1A1KMT2A
SCHEMBL10341100 0.76 RAB9A (0.46) SMN1; SMN2NPC1RAB9ATP53PKM
SCHEMBL9651972 0.74 KDM4E (0.52) SMN1; SMN2NPC1ALDH1A1KMT2AMEN1
SCHEMBL2779986 0.74 HTT (0.46) MAPK1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL10341108 0.73 ATM (0.44) SMN1; SMN2NPC1RAB9AALDH1A1KMT2A
SCHEMBL9619743 0.73 KMT2A (0.60) MAPK1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL9619579 0.72 RAB9A (0.50) MAPK1SMN1; SMN2NPC1RAB9ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62249966-A — — None — — JP disclosed
EP-0280275-B1 N-INDANYL CARBOXAMIDE DERIVATIVE AND AGRICULTURAL/HORTICULTURAL FUNGICIDE CONTAINING THE DERIVATIVE AS ACTIVE INGREDIENT MITSUBISHI KASEI CORPORATION (JP) 1992-04-29 — — EP disclosed
US-4956375-A HETEROCYCLIC SUBSTITUTED FUNGICIDES MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1990-09-11 — — US disclosed
US-4914097-A N-indanyl carboxamide derivative and agricultural/horticultural fungicide containing the derivative as active ingredient MITSUBISHI KASEI CORPORATION (JP) 1990-04-03 — — US disclosed
EP-0280275-A2 N-indanyl carboxamide derivative and agricultural/horticultural fungicide containing the derivative as active ingredient MITSUBISHI KASEI CORPORATION (JP) 1988-08-31 — — EP disclosed
JP-S62249966-A N-INDANYLAMIDE DERIVATIVE AND FUNGICIDE CONTAINING SAME AS ACTIVE INGREDIENT SUMITOMO CHEM CO LTD 1987-10-30 — — JP disclosed
Send feedback