SCHEMBL12646995

SCHEMBL12646995

O=C(c1ccc(NCc2ccc(CF)cc2)nc1)c1c[nH]c2ncccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.52
▸ KIT P10721 2/20 0.52
▸ KDR P35968 3/20 0.48
▸ ADORA2A P29274 1/20 0.44
▸ MAP2K1 Q02750 1/20 0.43
▸ PKM P14618 1/20 0.42
▸ CDC7 O00311 2/20 0.40
▸ ROCK2 O75116 2/20 0.40
▸ PIM1 P11309 2/20 0.40
▸ PRKACA P17612 2/20 0.40
▸ CDK2 P24941 2/20 0.40
▸ FLT3 P36888 2/20 0.40
▸ GSK3B P49841 2/20 0.40
▸ JAK3 P52333 2/20 0.40
▸ HIPK2 Q9H2X6 2/20 0.40
▸ PLK4 O00444 1/20 0.40
▸ CHEK1 O14757 1/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ EGFR P00533 1/20 0.40
▸ INSR P06213 1/20 0.40

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
SCHEMBL878912 0.92 CSF1R (0.52) CSF1RKITKDRADORA2AMAP2K1
SCHEMBL1267898 0.91 ADORA2A (0.55) CSF1RKITKDRADORA2AMAP2K1
SCHEMBL878837 0.89 CSF1R (0.68) CSF1RKITKDRADORA2ACDC7
SCHEMBL12927332 0.88 CSF1R (0.50) CSF1RKITKDRADORA2AMAP2K1
SCHEMBL15987202 0.85 KIT (0.55) CSF1RKITKDRMAP2K1PKM
SCHEMBL1268072 0.85 CLK1 (0.50) CSF1RKITKDRADORA2APKM
SCHEMBL4531204 0.83 CDC7 (0.48) CSF1RKITKDRADORA2AMAP2K1
SCHEMBL878889 0.81 HDAC3 (0.44) CSF1RKITKDRADORA2AMAP2K1
SCHEMBL858185 0.80 HCAR3 (0.54) CSF1RKITKDRADORA2AMAP2K1
SCHEMBL12646996 0.80 CSF1R (0.78) CSF1RKITKDRCDC7ROCK2

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
US-7947708-B2 Compounds modulating C-kit activity PLEXXIKON, INC. (US) 2011-05-24 — — US disclosed
US-7893075-B2 Compounds modulating c-fms and/or c-kit activity and uses therefor PLEXXIKON, INC. (US) 2011-02-22 — — US disclosed
US-20090105297-A1 Compounds Modulating C-Kit Activity PLEXXIKON INC 2009-04-23 — — US disclosed
US-20090076046-A1 Compounds modulating c-fms and/or c-kit activity and uses therefor PLEXXIKON INC 2009-03-19 — — 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 (2 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-20090076046-A1 Compounds modulating c-fms and/or c-kit activity and uses therefor KIT, FLT3, FLT1 CSF1R 4/4885KIT 1/4885KDR 21/4885
US-20090105297-A1 Compounds Modulating C-Kit Activity KIT, CDC7, CDK7 CSF1R 363/4885KIT 1/4885KDR 38/4885

“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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