SCHEMBL15317703

SCHEMBL15317703

COCCC1CCCN(C(=O)c2ccc(C(C)(C)C)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.54
▸ MEN1 O00255 6/20 0.54
▸ ALDH1A1 P00352 4/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ HTT P42858 1/20 0.54
▸ POLB P06746 2/20 0.53
▸ GRM3 Q14832 3/20 0.50
▸ HPGD P15428 3/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ PLA2G1B P04054 1/20 0.45
▸ ATG4B Q9Y4P1 1/20 0.45
▸ RAB9A P51151 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
SCHEMBL15317708 0.89 KMT2A (0.58) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL15317651 0.84 KMT2A (0.61) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL17886682 0.84 KMT2A (0.54) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL15317723 0.84 KMT2A (0.54) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL15317650 0.81 KMT2A (0.57) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL15317634 0.81 KMT2A (0.57) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL15317712 0.79 MEN1 (0.61) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL10724025 0.78 AKR1C3 (0.58) KMT2AMEN1ALDH1A1POLBGRM3
SCHEMBL15317727 0.78 SMN1; SMN2 (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2HTT
SCHEMBL15317685 0.77 MEN1 (0.66) KMT2AMEN1ALDH1A1SMN1; SMN2HTT

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 KMT2A 3615/4885MEN1 3827/4885ALDH1A1 875/4885

“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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