SCHEMBL15317710

SCHEMBL15317710

CC(C)(C)c1ccc(C(=O)N2CCCC(Cn3ccnc3)C2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ CYP19A1 P11511 13/20 0.48
▸ PLA2G1B P04054 1/20 0.46
▸ ATG4B Q9Y4P1 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ MAPK1 P28482 1/20 0.45

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
SCHEMBL10196674 0.88 CYP19A1 (0.50) KMT2ACYP19A1RECQL
SCHEMBL15317634 0.81 KMT2A (0.57) ALDH1A1SMN1; SMN2MEN1HTTKMT2A
SCHEMBL15317702 0.80 KMT2A (0.48) ALDH1A1SMN1; SMN2MEN1HTTKMT2A
SCHEMBL15317651 0.80 KMT2A (0.61) ALDH1A1SMN1; SMN2MEN1HTTKMT2A
SCHEMBL15317708 0.78 KMT2A (0.58) ALDH1A1SMN1; SMN2MEN1HTTKMT2A
SCHEMBL15317801 0.78 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2MEN1HTTKMT2A
SCHEMBL14266348 0.77 CYP19A1 (0.49) ALDH1A1MEN1KMT2ACYP19A1
SCHEMBL15317650 0.77 KMT2A (0.57) ALDH1A1SMN1; SMN2MEN1HTTKMT2A
SCHEMBL15317800 0.77 KMT2A (0.59) ALDH1A1SMN1; SMN2MEN1HTTKMT2A
SCHEMBL17886712 0.75 HPGD (0.56) ALDH1A1SMN1; SMN2MEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9073892-B2 Indazolyl triazol derivatives MERCK SERONO S.A. (CH) 2015-07-07 — — US disclosed
US-9073892-B2 Indazolyl triazol derivatives MERCK SERONO S.A. (CH) 2015-07-07 — — US disclosed
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 — — US disclosed
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 — — 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-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES NFATC1, IL5, CD4 ALDH1A1 875/4885SMN1; SMN2 3843/4885MEN1 3827/4885

“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.

Send feedback