SCHEMBL7995040

SCHEMBL7995040

CCc1ccc(NC(=O)OCCOc2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.76
NPC1 O15118 5/20 0.76
SMN1; SMN2 Q16637 2/20 0.76
TSHR P16473 1/20 0.76
LMNA P02545 1/20 0.67
TP53 P04637 1/20 0.67
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
HPGD P15428 2/20 0.56
CRHBP P24387 1/20 0.56
CRHR2 Q13324 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
FAAH O00519 6/20 0.55
MAPT P10636 3/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
RECQL P46063 1/20 0.54
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.52
THRB P10828 1/20 0.52

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
SCHEMBL17342583 0.89 NPC1 (0.80) RAB9ANPC1SMN1; SMN2TSHRLMNA
SCHEMBL4076346 0.87 NPC1 (1.00) RAB9ANPC1SMN1; SMN2TSHRLMNA
SCHEMBL7994882 0.86 NPC1 (0.80) RAB9ANPC1SMN1; SMN2TSHRLMNA
SCHEMBL7994779 0.83 NPC1 (0.80) RAB9ANPC1SMN1; SMN2TSHRLMNA
SCHEMBL12549885 0.81 RAB9A (0.88) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL13073361 0.81 RAB9A (0.56) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL7472487 0.81 SMN1; SMN2 (0.67) RAB9ANPC1SMN1; SMN2TSHRTP53
SCHEMBL7980669 0.80 NPC1 (0.80) RAB9ANPC1SMN1; SMN2TSHRLMNA
SCHEMBL12012741 0.80 RAB9A (0.54) RAB9ANPC1SMN1; SMN2TSHRLMNA
SCHEMBL592715 0.80 POLB (0.66) RAB9ANPC1SMN1; SMN2TSHRTP53

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
US-6294502-B1 Thermally-responsive record material BAYER AKTIENGESELLSCHAFT (DE) 2001-09-25 US claimed
WO-1999061251-A1 THERMALLY-RESPONSIVE RECORD MATERIAL CONTAINING A CARBAMATE COMPONENT BAYER AKTIENGESELLSCHAFT (DE) 1999-12-02 WO claimed
US-6294502-B1 Thermally-responsive record material BAYER AKTIENGESELLSCHAFT (DE) 2001-09-25 US disclosed
US-6015771-A ENHANCED IMAGE INTENSITY OR IMPROVED THERMAL RESPONSE, CARBAMATE BAYER AKTIENGESELLSCHAFT (DE) 2000-01-18 US disclosed
WO-1999061251-A1 THERMALLY-RESPONSIVE RECORD MATERIAL CONTAINING A CARBAMATE COMPONENT BAYER AKTIENGESELLSCHAFT (DE) 1999-12-02 WO disclosed