SCHEMBL27653109

SCHEMBL27653109

Oc1ccccc1-c1cccc2[nH]c3ccccc3c12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.72
IMPDH1 P20839 1/20 0.72
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CDK4 P11802 4/20 0.47
CCND1 P24385 4/20 0.47
ALDH1A1 P00352 3/20 0.46
GPR3 P46089 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GABRP O00591 1/20 0.46
GABRD O14764 1/20 0.46
GABRA1 P14867 1/20 0.46
GABRB1 P18505 1/20 0.46
GABRG2 P18507 1/20 0.46
GABRB3 P28472 1/20 0.46
GABRA5 P31644 1/20 0.46
GABRA3 P34903 1/20 0.46
GABRA2 P47869 1/20 0.46

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
SCHEMBL30565440 1.00 IMPDH2 (0.72) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL18209358 0.89 IMPDH2 (0.68) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL5933739 0.88 IMPDH2 (0.63) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL1326375 0.86 IMPDH2 (0.61) IMPDH2IMPDH1CDK4CCND1ALDH1A1
SCHEMBL866840 0.86 IMPDH2 (0.61) IMPDH2IMPDH1CDK4CCND1ALDH1A1
SCHEMBL151982 0.84 IMPDH2 (1.00) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL30700809 0.84 IMPDH2 (1.00) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL31780731 0.84 IMPDH2 (1.00) IMPDH2IMPDH1CA1CA2CA4
SCHEMBL20261907 0.81 IMPDH2 (0.55) IMPDH2IMPDH1CDK4CCND1ALDH1A1
SCHEMBL5665317 0.80 IMPDH2 (0.51) IMPDH2IMPDH1CA1CA2CA4

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
CN-116790007-A Preparation method of soluble nitrogenous polyarylether film with low toxicity solvent 大连中科聚合新材料科技有限公司 2023-09-22 CN claimed
CN-1937994-A Keratin dyeing compounds, keratin dyeing compositions containing them and their use PROCTER & GAMBLE (US) 2007-03-28 CN disclosed