SCHEMBL1937518

SCHEMBL1937518

COc1cncc(-c2c(-c3ccccc3F)nnc(Cl)c2-c2c(F)cc(F)cc2F)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 13/20 0.40
CYP11B2 P19099 12/20 0.37
CYP17A1 P05093 3/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CYP3A4 P08684 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
DHODH Q02127 1/20 0.34
TEK Q02763 1/20 0.33

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
SCHEMBL1937699 0.89 ABL1 (0.37) NPC1RAB9AADORA2AADORA1DHODH
SCHEMBL1936059 0.79 PRMT5 (0.41) CYP11B1CYP11B2CYP1A2DHODH
SCHEMBL1938105 0.78 PTGS1 (0.36) NPC1RAB9AADORA2AADORA1TEK
SCHEMBL1937496 0.77 ABL1 (0.38) NPC1RAB9ACYP3A4CYP1A2CYP2C9
SCHEMBL1937723 0.77 ABL1 (0.38) NPC1RAB9AADORA2AADORA1DHODH
SCHEMBL1936286 0.76 ALDH1A1 (0.34) NPC1RAB9AADORA2AADORA1DHODH
SCHEMBL3581885 0.72 NPC1 (0.44) CYP11B1CYP11B2NPC1RAB9A
SCHEMBL1937991 0.71 ABL1 (0.39) NPC1RAB9AADORA2AADORA1DHODH
SCHEMBL1937549 0.69 NPC1 (0.36) NPC1RAB9AADORA2AADORA1
SCHEMBL15886391 0.69 PDE2A (0.41) NPC1RAB9AADORA2ADHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2330891-A1 FUNGICIDAL PYRIDAZINES E. I. du Pont de Nemours and Company (US) 2011-06-15 EP disclosed
US-20110136762-A1 FUNGICIDAL PYRIDAZINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-09 US disclosed
WO-2010036553-A1 FUNGICIDAL PYRIDAZINES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-04-01 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-20110136762-A1 FUNGICIDAL PYRIDAZINES PRDX1, PNPO, PRXL2A CYP11B1 132/4885CYP11B2 202/4885CYP17A1 514/4885

“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.