SCHEMBL16908401

SCHEMBL16908401

Cc1ccc(NC(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#C[Si](C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 10/20 0.64
▸ KIT P10721 8/20 0.64
▸ SRC P12931 1/20 0.60
▸ FGFR1 P11362 2/20 0.59
▸ KDR P35968 2/20 0.59
▸ CSF1R P07333 1/20 0.59

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
SCHEMBL4110676 0.91 KIT (0.78) ABL1KITFGFR1KDRCSF1R
SCHEMBL16755327 0.87 KIT (0.81) ABL1KITSRCFGFR1KDR
SCHEMBL28054441 0.83 ABL1 (0.69) ABL1KITSRC
SCHEMBL4099939 0.83 KIT (0.67) ABL1KITFGFR1KDRCSF1R
SCHEMBL24626425 0.82 KIT (0.75) ABL1KITSRCFGFR1KDR
SCHEMBL15774143 0.82 ABL1 (0.85) ABL1KITFGFR1
SCHEMBL29674969 0.82 KIT (0.80) ABL1KITSRC
SCHEMBL16755287 0.82 KIT (0.80) ABL1KITSRC
SCHEMBL16755306 0.82 ABL1 (0.63) ABL1KITSRCFGFR1
SCHEMBL29675075 0.82 KIT (0.74) ABL1KITSRCFGFR1KDR

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-9255107-B2 Heteroaryl alkyne compound and use thereof NANJING SANHOME PHARMACEUTICAL CO., LTD. (CN) 2016-02-09 — — US disclosed
US-20150299202-A1 HETEROARYL ALKYNE COMPOUND AND USE THEREOF NANJING SANHOME PHARMACEUTICAL CO., LTD. (CN) 2015-10-22 — — US disclosed
EP-2927232-A1 HETEROARYL ALKYNE COMPOUND AND APPLICATION THEREOF Nanjing Sanhome Pharmaceutical Co., Ltd. (CN) 2015-10-07 — — EP disclosed
EP-2896620-A1 ALKYNYL HETEROAROMATIC RING COMPOUND AND APPLICATION THEREOF Nanjing Sanhome Pharmaceutical Co., Ltd. (CN) 2015-07-22 — — EP 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-20150299202-A1 HETEROARYL ALKYNE COMPOUND AND USE THEREOF ABL1, ALK, ABL2 ABL1 1/4885KIT 163/4885SRC 5/4885

“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.

Send feedback