SCHEMBL7980980

SCHEMBL7980980

Cc1cccc(NC(=O)OCCOc2ccccc2C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.59
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 3/20 0.50
ALDH1A1 P00352 2/20 0.50
FAAH O00519 1/20 0.50
CYP3A4 P08684 1/20 0.50
MITF O75030 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
PAX8 Q06710 1/20 0.50
KLF5 Q13887 1/20 0.50
LMNA P02545 5/20 0.49
POLB P06746 2/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL7992789 0.89 NPSR1 (0.76) NPSR1NPC1RAB9AMEN1KMT2A
SCHEMBL7998343 0.88 NPSR1 (0.74) NPSR1NPC1RAB9AMEN1KMT2A
SCHEMBL7998271 0.88 NPSR1 (0.56) NPSR1NPC1RAB9AMEN1KMT2A
SCHEMBL7980666 0.84 RAB9A (0.74) NPSR1NPC1RAB9AMEN1KMT2A
SCHEMBL7980860 0.83 NPC1 (0.62) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL7992893 0.82 NPC1 (0.58) NPSR1NPC1RAB9AMEN1KMT2A
SCHEMBL7991544 0.82 TP53 (0.61) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL12288926 0.81 MAPK1 (0.65) MEN1KMT2AMAPK1ALDH1A1FAAH
SCHEMBL8211088 0.81 MAPK1 (0.57) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL7992735 0.81 MEN1 (0.62) NPSR1NPC1RAB9AMEN1KMT2A

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