SCHEMBL12083577

SCHEMBL12083577

Cc1nc(-c2cccnc2)ncc1C(=O)Nn1cc(C)c2cc(F)ccc21

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 6/20 0.73
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ THRB P10828 1/20 0.42
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ABL1 P00519 1/20 0.39
▸ BCR P11274 1/20 0.39
▸ CYP11B1 P15538 2/20 0.38
▸ CYP11B2 P19099 2/20 0.38
▸ IDE P14735 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KLKB1 P03952 1/20 0.38
▸ PDE5A O76074 2/20 0.38
▸ DHODH Q02127 1/20 0.37

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
SCHEMBL12083584 0.90 HPGDS (0.74) HPGDSLMNAMAPTCYP1A2CYP2C19
SCHEMBL12083580 0.88 HPGDS (0.58) HPGDSLMNAMAPTTHRBCYP1A2
SCHEMBL12083884 0.88 HPGDS (0.82) HPGDS
SCHEMBL12083808 0.85 HPGDS (0.63) HPGDS
SCHEMBL12083959 0.85 HPGDS (0.53) HPGDSLMNAMAPTTHRBCYP1A2
SCHEMBL14313456 0.85 HPGDS (0.53) HPGDSLMNAMAPTTHRBCYP1A2
SCHEMBL2474438 0.84 HPGDS (1.00) HPGDSKMT2AKLKB1
SCHEMBL12084155 0.84 HPGDS (0.60) HPGDS
SCHEMBL12084004 0.82 HPGDS (0.55) HPGDS
SCHEMBL12084090 0.82 HPGDS (0.70) HPGDSKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142516-B1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI SA (FR) 2012-12-26 — — EP disclosed
US-8258130-B2 Pyrimidine hydrazide compounds as PGDS inhibitors SANOFI (FR) 2012-09-04 — — US disclosed
US-8258130-B2 Pyrimidine hydrazide compounds as PGDS inhibitors SANOFI (FR) 2012-09-04 — — US disclosed
US-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2010-02-25 — — US disclosed
US-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2010-02-25 — — US disclosed
WO-2008121670-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS SANOFI-AVENTIS (FR) 2008-10-09 — — WO 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-20100048568-A1 PYRIMIDINE HYDRAZIDE COMPOUNDS AS PGDS INHIBITORS HRH2, HRH1, HRH4 HPGDS 10/4885LMNA 3470/4885MAPT 1931/4885

“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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