SCHEMBL13797659

SCHEMBL13797659

Cc1oc(-c2ccccc2)cc1C(=O)Nc1ccc(Nc2nc(N(C)C)c3ccccc3n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.62
▸ KMT2A Q03164 8/20 0.62
▸ ALDH1A1 P00352 7/20 0.62
▸ CYP3A4 P08684 6/20 0.62
▸ MAPT P10636 3/20 0.62
▸ CYP1A2 P05177 3/20 0.62
▸ L3MBTL1 Q9Y468 2/20 0.62
▸ CYP2D6 P10635 2/20 0.62
▸ CYP2C19 P33261 2/20 0.62
▸ CYP2C9 P11712 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ HPGD P15428 4/20 0.57
▸ ALOX12 P18054 1/20 0.57
▸ LMNA P02545 1/20 0.53
▸ DGAT1 O75907 1/20 0.49
▸ POLB P06746 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ GAA P10253 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
SCHEMBL13797657 0.81 DGAT1 (0.54) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL13794141 0.79 MCHR1 (0.68) ALDH1A1HPGDLMNA
SCHEMBL13797650 0.79 MAPT (0.51) MEN1KMT2AMAPTPOLB
SCHEMBL13797645 0.77 KDM4E (0.51) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL13797644 0.77 NPC1 (0.61) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL13797653 0.77 RXFP1 (0.56) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL13793479 0.76 MCHR1 (0.62) —
SCHEMBL13797658 0.76 TDP1 (0.60) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL13796619 0.75 CTNNB1 (0.52) MEN1KMT2AALDH1A1CYP3A4MAPT
SCHEMBL13797660 0.75 ADRA2A (0.47) MEN1KMT2AALDH1A1CYP3A4MAPT

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 3 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
US-20070037836-A1 Melanin concentrating hormone; obesity and related disorders, anxiety, or depression; trans-4-Bromo-N-{4-[(4-dimethylamino-quinazolin-2-ylamino)-methyl]-cyclohexylmethyl}-2-trifluoromethoxy-benzenesulfonamide TAISHO PHARMACEUTICAL CO., LTD. (JP) 2007-02-15 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070037836-A1 Melanin concentrating hormone; obesity and related disorders, anxiety, or depression; trans-4-Bromo-N-{4-[(4-dimethylamino-quinazolin-2-ylamino)-methyl]-cyclohexylmethyl}-2-trifluoromethoxy-benzenesulfonamide MCHR1, MCHR2, MC4R MEN1 577/4885KMT2A 633/4885ALDH1A1 1616/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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