SCHEMBL15765836

SCHEMBL15765836

Cc1cccc(NNN)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ NOS3 P29474 1/20 0.46
▸ NOS2 P35228 1/20 0.46
▸ GRM5 P41594 4/20 0.46
▸ KDM4E B2RXH2 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ CCR1 P32246 1/20 0.44
▸ CCR8 P51685 1/20 0.44
▸ FDPS P14324 1/20 0.44
▸ FDFT1 P37268 1/20 0.44
▸ P2RX7 Q99572 1/20 0.44
▸ GBA1 P04062 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42

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
SCHEMBL30754820 0.82 — —
SCHEMBL2007460 0.82 — —
Hydrochloric Acid SCHEMBL10754017 0.80 RAB9A (0.53) RAB9AMEN1KMT2ANOS3NOS2
SCHEMBL19151683 0.80 RAB9A (0.53) RAB9AMEN1KMT2AGRM5KDM4E
Hydrochloric Acid SCHEMBL28207253 0.80 RAB9A (0.53) RAB9AMEN1KMT2ANOS3NOS2
SCHEMBL229747 0.77 RAB9A (0.59) RAB9AMEN1KMT2AGRM5KDM4E
SCHEMBL30558522 0.75 — —
SCHEMBL306134 0.75 — —
SCHEMBL27665125 0.74 RAB9A (0.52) RAB9AMEN1KMT2AGRM5KDM4E
SCHEMBL19915750 0.73 — —

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-9238039-B2 Pyrazolo[1,5-A]pyrimidines for antiviral treatment GILEAD SCIENCES, INC. (US) 2016-01-19 — — US disclosed
US-20140154240-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2014-06-05 — — 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-20140154240-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT TYMP, ZC3HAV1, TYMS RAB9A 2243/4885MEN1 3578/4885KMT2A 3648/4885

“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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