SCHEMBL15317801

SCHEMBL15317801

CC(C)(C)c1ccc(C(=O)N2CCCC(CN3CCOCC3)C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ HTT P42858 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ GAA P10253 1/20 0.49
▸ BTK Q06187 1/20 0.47
▸ PARP1 P09874 1/20 0.47
▸ HPGD P15428 3/20 0.46
▸ NPC1L1 Q9UHC9 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ NPC1 O15118 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
SCHEMBL15317634 0.91 KMT2A (0.57) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL10195742 0.87 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AGAAPARP1
SCHEMBL15317651 0.82 KMT2A (0.61) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL17886736 0.81 L3MBTL3 (0.56) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL15317708 0.80 KMT2A (0.58) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL15317678 0.80 MAPT (0.69) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL15317650 0.79 KMT2A (0.57) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL15317800 0.79 KMT2A (0.59) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL15317681 0.78 HPGD (0.48) ALDH1A1KMT2AMAPTGAAHPGD
SCHEMBL15317710 0.78 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ASMN1; 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 ALDH1A1 875/4885MEN1 3827/4885KMT2A 3615/4885

“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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