SCHEMBL14235595

SCHEMBL14235595

Fc1ccc(Cl)c(CNc2ncc(CC3CNc4ncc(Cl)cc43)cn2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ ALK Q9UM73 1/20 0.34
▸ JAK2 O60674 2/20 0.34
▸ JAK1 P23458 2/20 0.34
▸ JAK3 P52333 2/20 0.34
▸ NTRK1 P04629 2/20 0.34
▸ P2RX7 Q99572 3/20 0.32
▸ CCNT1 O60563 1/20 0.32
▸ CDK9 P50750 1/20 0.32
▸ HDAC3 O15379 2/20 0.32
▸ RXRA P19793 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ VNN1 O95497 2/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ HCRTR1 O43613 1/20 0.31

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
SCHEMBL14235873 0.89 HDAC3 (0.37) CYP2C9CYP3A4ALKJAK2JAK1
SCHEMBL14236264 0.88 VNN1 (0.42) NTRK1HDAC3VNN1HDAC1HDAC2
SCHEMBL14236233 0.85 NTRK1 (0.41) NTRK1CCNT1
SCHEMBL14235596 0.85 NTRK1 (0.33) CYP2C9CYP3A4NTRK1CCNT1CDK9
SCHEMBL14235722 0.84 HDAC3 (0.47) NTRK1HDAC3HDAC1HDAC2HDAC6
SCHEMBL14236211 0.81 HDAC1 (0.38) CYP2C9CCNT1HDAC3VNN1ROCK2
SCHEMBL14236271 0.81 VNN1 (0.41) NTRK1HDAC3VNN1HDAC1HDAC2
SCHEMBL14235887 0.80 SLC2A1 (0.43) JAK3P2RX7CDK9HDAC3HDAC1
SCHEMBL14236090 0.80 HDAC3 (0.45) HDAC3VNN1HDAC1HDAC2HDAC6
SCHEMBL14235899 0.80 P2RX7 (0.33) CYP2C9CYP3A4P2RX7CDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120309756-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR PLEXXIKON INC 2012-12-06 — — 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-20120309756-A1 COMPOUNDS MODULATING C-FMS AND/OR C-KIT ACTIVITY AND USES THEREFOR KIT, FLT3, FLT1 CYP2C9 4122/4885CYP3A4 3847/4885ALK 384/4885

“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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