SCHEMBL6865149

SCHEMBL6865149

CCCCC(Oc1ccc(N)cc1)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
TP53 P04637 1/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
PDE4D Q08499 1/20 0.50
PLA2G4B P0C869 7/20 0.49
KMT2A Q03164 1/20 0.49
RARB P10826 4/20 0.47
PLA2G4A P47712 1/20 0.45
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.43

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
SCHEMBL2180724 0.93 TP53 (0.57) TSHRTP53PLA2G4BKMT2ARARB
SCHEMBL1445548 0.88 TP53 (0.59) TSHRTP53PLA2G4BKMT2ARARB
SCHEMBL9860125 0.87 TP53 (0.62) TSHRTP53PLA2G4BKMT2ARARB
SCHEMBL2183384 0.87 TP53 (0.62) TSHRTP53PLA2G4BKMT2ARARB
SCHEMBL2181006 0.87 TP53 (0.62) TSHRTP53PLA2G4BKMT2ARARB
SCHEMBL2535207 0.86 TDP1 (0.45) TSHRLMNACYP1A2CYP3A4CYP2C9
SCHEMBL1952125 0.83 KMT2A (0.59) TSHRTP53PLA2G4BKMT2ARARB
SCHEMBL10595641 0.81 TDP1 (0.44) TSHRLMNACYP1A2CYP3A4CYP2C9
SCHEMBL25283342 0.80 SLC2A1 (0.44) TSHRLMNACYP1A2CYP3A4CYP2C9
SCHEMBL7908097 0.80 SLC2A1 (0.44) TSHRLMNACYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6808766-B1 ALIGNMENT AGENT COMPRISING POLYURETHANE OR POLYUREA, USED IN ALIGNMENT OF LIQUID CRYSTAL MOLECULES THAT FORM LIQUID CRYSTAL ALIGNMENT FILM BY IRRADIATING THIN ALIGNMENT FILM FORMED ON SUBSTRATE WITH POLARIZED LIGHT OR ELECTRON RAYS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-10-26 US disclosed
EP-1111442-A1 TREATING AGENT FOR LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DEVICE USING THE SAME, AND METHOD FOR ALIGNMENT OF LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2001-06-27 EP disclosed