SCHEMBL7992893

SCHEMBL7992893

Cc1ccccc1NC(=O)OCCOc1ccccc1C

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.58
RAB9A P51151 5/20 0.58
NPSR1 Q6W5P4 1/20 0.55
POLB P06746 1/20 0.54
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
MAPT P10636 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TDP1 Q9NUW8 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.48
NOTUM Q6P988 1/20 0.48

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
SCHEMBL7994876 0.90 NPSR1 (0.69) NPC1RAB9ANPSR1POLBMEN1
SCHEMBL7992723 0.89 NPC1 (0.53) NPC1RAB9ANPSR1MEN1KMT2A
SCHEMBL7998343 0.85 NPSR1 (0.74) NPC1RAB9ANPSR1POLBMEN1
SCHEMBL7980660 0.85 NPC1 (0.68) NPC1RAB9ANPSR1MEN1KMT2A
SCHEMBL7980688 0.83 KMT2A (0.59) NPC1RAB9ANPSR1POLBMEN1
SCHEMBL7980980 0.82 NPSR1 (0.59) NPC1RAB9ANPSR1POLBMEN1
SCHEMBL7994880 0.82 MEN1 (0.53) NPC1RAB9ANPSR1POLBMEN1
SCHEMBL17856292 0.81 NPC1 (0.65) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL7980668 0.81 MEN1 (0.60) NPC1RAB9ANPSR1MEN1KMT2A
SCHEMBL7992673 0.81 RAB9A (0.54) NPC1RAB9ANPSR1MEN1KMT2A

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 4 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
WO-1999061251-A1 THERMALLY-RESPONSIVE RECORD MATERIAL CONTAINING A CARBAMATE COMPONENT BAYER AKTIENGESELLSCHAFT (DE) 1999-12-02 WO disclosed