SCHEMBL7693296

SCHEMBL7693296

Cc1nc2c(Cl)cc(C(=O)O)cc2o1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TTR P02766 7/20 0.43
RARA P10276 6/20 0.38
RARB P10826 6/20 0.38
RARG P13631 6/20 0.38
TPMT P51580 3/20 0.38
TSHR P16473 2/20 0.38
ALB P02768 1/20 0.38
MAOA P21397 1/20 0.38
CNR1 P21554 1/20 0.38
DRD1 P21728 1/20 0.38
OPRD1 P41143 1/20 0.38
PDE4D Q08499 1/20 0.38
PDE3A Q14432 1/20 0.38
GPR35 Q9HC97 1/20 0.37
ALOX15 P16050 1/20 0.36
HIF1A Q16665 1/20 0.36
MAPT P10636 1/20 0.34

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
SCHEMBL5074818 0.83 ALDH1A1 (0.38) HIF1AMAPT
SCHEMBL18042395 0.81 FPR2 (0.34) CNR1MAPT
SCHEMBL20031232 0.81 RARA (0.38) TTRRARARARBRARGTPMT
SCHEMBL25114081 0.81 TTR (0.43) TTRTPMTTSHRALBMAOA
SCHEMBL16615463 0.80 KMO (0.50)
SCHEMBL26579752 0.78 CA12 (0.49) TTRTPMTTSHRGPR35
SCHEMBL22672668 0.77 PTGES (0.40) TTRRARARARBRARGTPMT
SCHEMBL18042356 0.77
SCHEMBL22672586 0.76 MAPT (0.38) RARBRARGTPMTTSHRGPR35
SCHEMBL26579791 0.76 TTR (0.39) TTRTPMTTSHRALBMAOA

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-6500405-B1 EVALUATING THE SENSITIVITY OF A TEST CELL POPULATION TO AN ANTITUBULIN COMPOUND COMPRISING INCUBATING CELLS OR CELL EXTRACTS WITH AN AMIDE PROBE IN THE PRESENCE AND ABSENCE OF AN ANTITUBULIN TEST COMPOUND DOW AGROSCIENCES LLC 2002-12-31 US disclosed
US-6140362-A INHIBITING MAMMALIAN CELL GROWTH IN BENIGN OR MALIGNANT TUMORS COMPRISING TREATING SAID CELLS WITH AN EFFECTIVE AMOUNT OF A N-ACETONYLARYLAMIDES COMPOUND ROHM AND HAAS COMPANY (US) 2000-10-31 US disclosed
EP-0843018-B1 Use of certain amides as probes for detection of antitubulin activity and resistance monitoring ROHM & HAAS (US) 2000-07-05 EP disclosed
EP-0843018-A1 Use of certain amides as probes for detection of antitubulin activity and resistance monitoring ROHM AND HAAS COMPANY (US) 1998-05-20 EP disclosed
EP-0834311-A1 Method for inhibiting the growth of mammalian cells ROHM AND HAAS COMPANY (US) 1998-04-08 EP disclosed