SCHEMBL12342109

SCHEMBL12342109

CCN(CC)CCOc1cnc2c(c1)C(Cc1ccc(NCc3ccc(C(F)(F)F)cc3)nc1)CN2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.42
▸ KIT P10721 1/20 0.38
▸ CACNA1B Q00975 2/20 0.35
▸ TP53 P04637 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ RPS6KB1 P23443 1/20 0.33
▸ LYN P07948 6/20 0.33
▸ SRC P12931 5/20 0.32
▸ BTK Q06187 3/20 0.32
▸ ALK Q9UM73 1/20 0.32
▸ NPC1 O15118 2/20 0.31
▸ CCND3 P30281 1/20 0.31
▸ CDK6 Q00534 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL13056393 0.85 KDM4E (0.34) GAAMAPTSRCNPC1RAB9A
SCHEMBL12925721 0.84 CACNA1B (0.44) CSF1RKITCACNA1BAURKARPS6KB1
SCHEMBL14236085 0.82 RPS6KB1 (0.45) CSF1RKITCACNA1BAURKARPS6KB1
SCHEMBL12304343 0.80 CSF1R (0.43) CSF1RKITGAAMAPTNPC1
SCHEMBL13056388 0.77 CSF1R (0.52) CSF1RKITNPC1CCND3CDK6
SCHEMBL1267558 0.75 CSF1R (0.75) CSF1RKIT
SCHEMBL12927443 0.73 CSF1R (0.46) CSF1RKITTP53GAAMAPT
SCHEMBL1266959 0.71 CSF1R (0.74) CSF1RKITCACNA1B
SCHEMBL24594059 0.71 CSF1R (0.54) CSF1RKIT
SCHEMBL12341853 0.70 CSF1R (0.54) CSF1RKITCACNA1BTP53GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268858-B2 e.g. 5-(3-methoxybenzyloxy)-1H-pyrrolo[2,3-b]pyridine; protein kinases inhibitor; central nervous system disorders; Alzheimer's disease; Parkinson's disease; anticancer, antitumor agents; analgesics; cogestive heart failure; skin disorders; inflammatory bowel disorders; transplant rejection PLEXXIKON INC. (US) 2012-09-18 — — US disclosed
US-20080188514-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC 2008-08-07 — — 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-20080188514-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 CSF1R 2023/4885KIT 1117/4885CACNA1B 3325/4885

“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