SCHEMBL13765780

SCHEMBL13765780

Cc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1C#Cc1cccnc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 3/20 0.71
KIT P10721 8/20 0.69
ABL1 P00519 1/20 0.57
NAMPT P43490 1/20 0.57
NPC1 O15118 1/20 0.56
DDR1 Q08345 5/20 0.55
CYP11B2 P19099 2/20 0.53
CYP11B1 P15538 1/20 0.53
BRAF P15056 1/20 0.51
HIF1A Q16665 1/20 0.50
EPAS1 Q99814 1/20 0.50
RAB9A P51151 1/20 0.50
RET P07949 1/20 0.50

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
SCHEMBL13765874 0.90 CSF1R (0.76) CSF1RKITABL1NAMPTNPC1
SCHEMBL22854604 0.83 CSF1R (0.68) CSF1RKITABL1NPC1DDR1
SCHEMBL24925293 0.82 CSF1R (0.65) CSF1RKITABL1NPC1DDR1
SCHEMBL29602539 0.82 CSF1R (0.65) CSF1RKITABL1NPC1DDR1
SCHEMBL11297061 0.82 CSF1R (0.67) CSF1RKITABL1NPC1DDR1
SCHEMBL22854667 0.81 CSF1R (0.63) CSF1RKITABL1NPC1DDR1
SCHEMBL22833839 0.80 CSF1R (0.65) CSF1RKITABL1NAMPTNPC1
SCHEMBL29506321 0.80 CSF1R (0.65) CSF1RKITABL1NAMPTNPC1
SCHEMBL22833926 0.79 CSF1R (0.64) CSF1RKITABL1DDR1
SCHEMBL4063968 0.79 CSF1R (0.62) CSF1RKITABL1DDR1

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-9090561-B2 Acetylenic heteroaryl compounds ARIAD PHARMACEUTICALS, INC. (US) 2015-07-28 US disclosed
US-8461167-B2 Acetylenic heteroaryl compounds ARIAD PHARMACEUTICALS, INC. (US) 2013-06-11 US disclosed
US-8461167-B2 Acetylenic heteroaryl compounds ARIAD PHARMACEUTICALS, INC. (US) 2013-06-11 US disclosed
US-20090176781-A1 Acetylenic Heteroaryl Compounds ARIAD PHARMACEUTICALS, INC. 2009-07-09 US disclosed
WO-2007133560-A9 ACETYLENIC HETEROARYL COMPOUNDS ARIAD PHARMA INC (US) 2008-11-13 WO disclosed
WO-2007133560-A2 ACETYLENIC HETEROARYL COMPOUNDS ARIAD PHARMACEUTICALS, INC. (US) 2007-11-22 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-20090176781-A1 Acetylenic Heteroaryl Compounds NAT1, AADAC, ACACA CSF1R 3269/4885KIT 3086/4885ABL1 1035/4885

“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.