SCHEMBL1231173

SCHEMBL1231173

Cn1nccc(NC(=O)N2CCC(Oc3cc(F)cc(C(F)(F)F)c3)CC2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 1/20 0.43
▸ CSF1R P07333 2/20 0.41
▸ EPHX2 P34913 2/20 0.41
▸ BRAF P15056 3/20 0.40
▸ KDR P35968 3/20 0.40
▸ S1PR2 O95136 2/20 0.38
▸ LOXL2 Q9Y4K0 2/20 0.38
▸ GPR6 P46095 1/20 0.37
▸ NTRK1 P04629 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ NTRK3 Q16288 1/20 0.37
▸ NTRK2 Q16620 1/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ DRD3 P35462 1/20 0.36

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
SCHEMBL1230463 0.88 EPHX2 (0.54) SCDCSF1REPHX2
SCHEMBL1231156 0.87 SCD (0.44) SCDCSF1RBRAFKDR
SCHEMBL1229145 0.84 HRH1 (0.41) SCDEPHX2GPR6NTRK1KCNH2
SCHEMBL1231030 0.84 SCD (0.54) SCDCSF1REPHX2LOXL2GPR6
SCHEMBL1230256 0.82 SCD (0.45) SCDEPHX2GPR6
SCHEMBL1230439 0.81 SCD (0.67) SCDCSF1R
SCHEMBL1231202 0.80 GPR6 (0.45) SCDGPR6
SCHEMBL1230343 0.79 SCD (0.41) SCDCSF1REPHX2GPR6
SCHEMBL1230324 0.79 CCR3 (0.48) KCNH2
SCHEMBL1231168 0.78 SCD (0.53) SCDEPHX2GPR6

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
US-8946225-B2 Derivatives of 2H pyridazin-3-ones, their preparation and their use as SCD-1 inhibitors PIERRE FABRE MEDICAMENT (FR) 2015-02-03 — — US disclosed
US-8946225-B2 Derivatives of 2H pyridazin-3-ones, their preparation and their use as SCD-1 inhibitors PIERRE FABRE MEDICAMENT (FR) 2015-02-03 — — US disclosed
US-20120178678-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2012-07-12 — — US disclosed
US-20120178678-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2012-07-12 — — US disclosed
WO-2011015629-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2011-02-10 — — WO disclosed
WO-2011015629-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2011-02-10 — — 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-20120178678-A1 DERIVATIVES OF 2H PYRIDAZIN- 3 -ONES, THEIR PREPARATION AND THEIR USE AS SCD-1 INHIBITORS SCD, SCD5, CYP2S1 SCD 1/4885CSF1R 584/4885EPHX2 1211/4885

“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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