SCHEMBL5914433

SCHEMBL5914433

Cc1cc(N(C)c2ccnc(-c3ccccc3)n2)nc(N[C@@H](C)Cc2cccc(CNC(=O)[C@H](C)N)c2)n1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CARM1 Q86X55 11/20 0.40
▸ ALDH1A1 P00352 3/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ TSHR P16473 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ MAPK14 Q16539 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ OPRK1 P41145 1/20 0.34
▸ KDR P35968 1/20 0.34

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
SCHEMBL5914436 1.00 CARM1 (0.40) CARM1ALDH1A1CYP3A4TSHRSMN1; SMN2
SCHEMBL5914143 0.86 SMN1; SMN2 (0.39) ALDH1A1CYP3A4TSHRSMN1; SMN2CYP1A2
SCHEMBL5914118 0.86 MAPK14 (0.42) ALDH1A1CYP3A4TSHRSMN1; SMN2CYP1A2
SCHEMBL5913787 0.83 MAPK14 (0.41) TSHRSMN1; SMN2MAPK14MAPTKMT2A
SCHEMBL5913794 0.83 MAPK14 (0.41) TSHRSMN1; SMN2MAPK14MAPTKMT2A
SCHEMBL5913917 0.81 CLK4 (0.43) ALDH1A1CYP3A4TSHRSMN1; SMN2CYP1A2
SCHEMBL5913924 0.81 CLK4 (0.43) ALDH1A1CYP3A4TSHRSMN1; SMN2CYP1A2
SCHEMBL5914289 0.81 CARM1 (0.38) CARM1MAPK14KDR
SCHEMBL5914294 0.81 CARM1 (0.38) CARM1MAPK14KDR
SCHEMBL5914093 0.80 MAPK14 (0.39) ALDH1A1CYP3A4TSHRSMN1; SMN2CYP1A2

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-20060069110-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2006-03-30 — — 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-20060069110-A1 Substituted heterocyclic compounds and methods of use MAPT, MYLK2, IAPP CARM1 1751/4885ALDH1A1 3019/4885CYP3A4 1290/4885

“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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