SCHEMBL11330573

SCHEMBL11330573

CC(Oc1cc(Cl)ccc1Cl)C(=O)Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
HTR2B P41595 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 4/20 0.47
HPGD P15428 2/20 0.47
ALOX12 P18054 2/20 0.47
CYP1A2 P05177 1/20 0.47
GLA P06280 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
GAA P10253 2/20 0.46
MAPK1 P28482 1/20 0.45
POLB P06746 1/20 0.44
PKM P14618 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
SCHEMBL9780720 0.86 SMN1; SMN2 (0.64) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL6704326 0.86 SMN1; SMN2 (0.64) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL7750963 0.86 SMN1; SMN2 (0.64) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL1305946 0.86 TSHR (0.69) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL11330542 0.86 TSHR (0.51) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL12656154 0.85 TSHR (0.50) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL11342743 0.82 HPGD (0.50) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL9487387 0.81 TSHR (0.77) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL11340856 0.81 SMN1; SMN2 (0.51) TSHRHTR2AHTR2CHTR2BSMN1; SMN2
SCHEMBL11210274 0.80 TSHR (0.45) TSHRHTR2AHTR2CHTR2BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4257801-A Cotton desiccation with phenoxyalkanoic acids IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-03-24 US disclosed