SCHEMBL14073656

SCHEMBL14073656

O=C1COc2ccc(NC(=O)c3ccc4nccnc4c3)cc2N1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.64
▸ ALDH1A1 P00352 7/20 0.64
▸ RAB9A P51151 4/20 0.64
▸ SMN1; SMN2 Q16637 4/20 0.64
▸ NPC1 O15118 4/20 0.64
▸ GAA P10253 3/20 0.64
▸ TP53 P04637 2/20 0.64
▸ POLB P06746 1/20 0.61
▸ KMT2A Q03164 2/20 0.57
▸ TRPV1 Q8NER1 2/20 0.52
▸ MALT1 Q9UDY8 2/20 0.50
▸ CYP3A4 P08684 2/20 0.49
▸ CYP2C9 P11712 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ KLK7 P49862 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49

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
SCHEMBL14073935 0.91 MAPT (0.64) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL14073608 0.88 MAPT (0.57) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL8192718 0.87 ALDH1A1 (0.77) MAPTALDH1A1GAAPOLBKMT2A
SCHEMBL14073652 0.87 ALDH1A1 (0.61) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL14073593 0.84 MAPT (0.58) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL14073031 0.84 ALDH1A1 (0.69) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL14073627 0.83 NPC1 (0.60) MAPTALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL14073572 0.83 KMT2A (0.63) MAPTALDH1A1RAB9ASMN1; SMN2GAA
SCHEMBL14073602 0.82 ALDH1A1 (0.58) MAPTALDH1A1GAAPOLBKMT2A
SCHEMBL14073421 0.82 TSHR (0.68) MAPTALDH1A1RAB9ANPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 — — US disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 — — 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-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety MMP12, MMP13, MMP25 MAPT 3986/4885ALDH1A1 714/4885RAB9A 2232/4885

“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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