SCHEMBL7967703

SCHEMBL7967703

C(OCC1CO1)C1CO1.C=C(CC=CC(=O)O)C(=O)OCCCC

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 3/20 0.40
HCAR2 Q8TDS4 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
TSHR P16473 3/20 0.34
ATM Q13315 1/20 0.34
HPGD P15428 1/20 0.33

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
SCHEMBL7973651 0.90 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1HCAR2TDP1TSHR
SCHEMBL7971090 0.89 TSHR (0.44) SMN1; SMN2ALDH1A1HCAR2TDP1TSHR
SCHEMBL7957132 0.88 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1HCAR2TDP1TSHR
SCHEMBL313840 0.85 HCAR2 (0.53) ALDH1A1HCAR2TDP1TSHRATM
SCHEMBL7966454 0.84 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1HCAR2TDP1TSHR
SCHEMBL7957619 0.84 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1HCAR2TDP1TSHR
SCHEMBL7967972 0.83 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1TSHR
SCHEMBL1219539 0.82 ALDH1A1 (0.53) ALDH1A1
SCHEMBL10482291 0.82 ALDH1A1 (0.47) ALDH1A1HCAR2TDP1TSHR
SCHEMBL325215 0.81 HCAR2 (0.54) SMN1; SMN2ALDH1A1HCAR2TSHRATM

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-6180691-B1 MIXING AN INK VEHICLE, A COLORANT AND A LATEX CONTAINING A POLYMER WITH EPOXY GROUPS, WHICH IS GENERATED BY POLYMERIZING A MIXTURE OF OLEFINIC MONOMERS AND AN UNSATURATED MONOMER CONTAINING EPOXIDE IN PRESENCE OF ANIONIC/NONIONIC XEROX CORPORATION 2001-01-30 US claimed
US-6180691-B1 MIXING AN INK VEHICLE, A COLORANT AND A LATEX CONTAINING A POLYMER WITH EPOXY GROUPS, WHICH IS GENERATED BY POLYMERIZING A MIXTURE OF OLEFINIC MONOMERS AND AN UNSATURATED MONOMER CONTAINING EPOXIDE IN PRESENCE OF ANIONIC/NONIONIC XEROX CORPORATION 2001-01-30 US disclosed