SCHEMBL28029637

SCHEMBL28029637

Oc1ccccc1-c1ccnc(-c2ccccc2O)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.56
SMN1; SMN2 Q16637 4/20 0.50
CASP3 P42574 2/20 0.47
SENP8 Q96LD8 2/20 0.47
SENP7 Q9BQF6 2/20 0.47
SENP6 Q9GZR1 2/20 0.47
MAPK1 P28482 1/20 0.46
KDM4A O75164 1/20 0.45
ALDH1A1 P00352 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
KDM1A O60341 5/20 0.43
IDO1 P14902 2/20 0.43
LMNA P02545 2/20 0.42
POLB P06746 1/20 0.42
RAB9A P51151 2/20 0.42

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
SCHEMBL6668685 0.87 LMNA (0.54) CYP19A1SMN1; SMN2CASP3SENP8SENP7
SCHEMBL9486774 0.85 CYP19A1 (0.54) CYP19A1SMN1; SMN2MAPK1ALDH1A1ALOX15
SCHEMBL27685200 0.82 SMN1; SMN2 (0.48) CYP19A1SMN1; SMN2CASP3SENP8SENP7
SCHEMBL13674053 0.81 KMT2A (0.56) CYP19A1SMN1; SMN2CASP3SENP8SENP7
SCHEMBL21083410 0.81 KMT2A (0.56) CYP19A1SMN1; SMN2CASP3SENP8SENP7
SCHEMBL31011602 0.81 CYP19A1 (0.45) CYP19A1SMN1; SMN2CASP3SENP8SENP7
SCHEMBL21083351 0.81 TGFBR1 (0.47) CYP19A1SMN1; SMN2CASP3SENP8SENP7
SCHEMBL30507532 0.81 CDK1 (0.57) SMN1; SMN2ADORA2AKDM1ALMNAKMT2A
SCHEMBL6763541 0.81 CDK1 (0.57) SMN1; SMN2ADORA2AKDM1ALMNAKMT2A
SCHEMBL3626006 0.81 CYP19A1 (0.45) CYP19A1SMN1; SMN2CASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103145624-B Molecular glass positive photoresist and patterning method thereof TECHNICAL INSTITUTE OF PHYSICS AND CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2015-08-05 CN disclosed