SCHEMBL4263362

SCHEMBL4263362

O=C(NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(Cl)nc(N2CCC(N3CCCC3)CC2)nc1Cl

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 1/20 0.46
▸ TACR1 P25103 13/20 0.45
▸ TSHR P16473 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NPY2R P49146 1/20 0.43
▸ CCR2 P41597 3/20 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
SCHEMBL4262145 0.83 TACR1 (0.48) TACR1CCR2
SCHEMBL1420423 0.70 KMT2A (0.53) TRPV4TSHRKMT2ACCR2
Hydrochloric Acid SCHEMBL6512689 0.69 TRPV4 (0.58) TRPV4TACR1
SCHEMBL24183601 0.68 TRPV4 (0.51) TRPV4TACR1TSHRKMT2ANPY2R
SCHEMBL24183606 0.66 HDAC3 (0.48) TRPV4KMT2A
SCHEMBL12552673 0.65 RBP4 (0.48) KMT2A
SCHEMBL5317188 0.65 TACR1 (0.78) TACR1
SCHEMBL14503410 0.65 CASP1 (0.54) TSHRKMT2A
SCHEMBL4257753 0.64 L3MBTL1 (0.50) —
SCHEMBL1961881 0.64 CSF1R (0.47) TRPV4NPY2R

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
EP-1473295-B1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES KYORIN SEIYAKU KK (JP) 2009-04-01 — — EP disclosed
US-6995153-B2 Fused bicyclic pyrimidine derivatives KYORIN PHARMACEUTICAL. CO., LTD. (JP) 2006-02-07 — — US disclosed
US-20050085469-A1 Fused bicyclic pyrimidine derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-04-21 — — US disclosed
EP-1473295-A1 FUSED BICYCLIC PYRIMIDINE DERIVATIVES Kyorin Pharmaceutical Co., Ltd. (JP) 2004-11-03 — — EP 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-20050085469-A1 Fused bicyclic pyrimidine derivatives BDKRB1, BDKRB2, TACR1 TRPV4 221/4885TACR1 3/4885TSHR 916/4885

“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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