SCHEMBL13797649

SCHEMBL13797649

Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1ccc(Nc2nc(N(C)C)c3ccccc3n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.56
▸ MEN1 O00255 4/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ XDH P47989 1/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ POLB P06746 3/20 0.49
▸ GAA P10253 2/20 0.48
▸ RAB9A P51151 4/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ NPC1 O15118 3/20 0.47
▸ ALDH1A1 P00352 5/20 0.44
▸ LMNA P02545 4/20 0.44
▸ NPSR1 Q6W5P4 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ HTT P42858 3/20 0.44

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
SCHEMBL13796619 0.83 CTNNB1 (0.52) MAPTMEN1KMT2ACYP3A4CYP2D6
SCHEMBL13797650 0.80 MAPT (0.51) MAPTMEN1KMT2APOLBRAB9A
SCHEMBL14606715 0.78 CTNNB1 (0.64) MAPTMEN1KMT2ACYP1A2CYP3A4
SCHEMBL13797658 0.78 TDP1 (0.60) MAPTMEN1KMT2ACYP1A2CYP3A4
SCHEMBL13797202 0.77 NPY5R (0.53) SMN1; SMN2
SCHEMBL13797660 0.77 ADRA2A (0.47) MAPTMEN1KMT2ACYP3A4CYP2D6
SCHEMBL13797653 0.75 RXFP1 (0.56) MAPTMEN1KMT2ACYP3A4SMN1; SMN2
SCHEMBL13797656 0.74 ADORA3 (0.54) MAPTMEN1KMT2ACYP3A4SMN1; SMN2
SCHEMBL13797657 0.73 DGAT1 (0.54) MAPTMEN1KMT2ACYP1A2CYP3A4
SCHEMBL13797641 0.73 MEN1 (0.50) MAPTMEN1KMT2ACYP3A4CYP2D6

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-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
US-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
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