SCHEMBL10697549

SCHEMBL10697549

Cc1cc(C(=O)c2ccccc2)c(C(=O)O)cc1N(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
AKR1C3 P42330 2/20 0.49
ALDH1A1 P00352 3/20 0.46
POLB P06746 3/20 0.46
GLA P06280 1/20 0.46
NPC1 O15118 1/20 0.45
HPGD P15428 1/20 0.45
RAB9A P51151 1/20 0.45
LTC4S Q16873 2/20 0.44
CDC25B P30305 2/20 0.44
CDC25A P30304 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C8 P10632 1/20 0.42
CYP2C9 P11712 1/20 0.42
LMNA P02545 1/20 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
SCHEMBL8785619 0.85 KDM4E (0.61) KDM4EAKR1C3ALDH1A1POLBCDC25B
SCHEMBL10691453 0.83 KDM4E (0.49) KDM4EAKR1C3ALDH1A1POLBGLA
SCHEMBL10694952 0.81 LMNA (0.51) KDM4EAKR1C3ALDH1A1POLBGLA
SCHEMBL10695457 0.79 KDM4E (0.67) KDM4EAKR1C3ALDH1A1POLBGLA
SCHEMBL6056968 0.77 AKR1C3 (0.71) KDM4EAKR1C3ALDH1A1POLBCDC25B
SCHEMBL30549431 0.77 AKR1C3 (0.71) KDM4EAKR1C3ALDH1A1POLBCDC25B
SCHEMBL15793780 0.77 AKR1C3 (0.71) KDM4EAKR1C3ALDH1A1POLBCDC25B
SCHEMBL6014019 0.77 AKR1C3 (0.71) KDM4EAKR1C3ALDH1A1POLBCDC25B
SCHEMBL6640244 0.76 SMN1; SMN2 (0.44) AKR1C3ALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL9384305 0.76 ALDH1A1 (0.72) KDM4EAKR1C3ALDH1A1POLBGLA

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
US-4748148-A Recording system utilizing phthalide derivatives as colorless chromogenic material NEW OJI PAPER CO., LTD. (JP) 1988-05-31 US disclosed