SCHEMBL15764708

SCHEMBL15764708

CN(C(=O)c1ccc(C(F)(F)F)nc1)c1ccn2ncc(-c3ccc(CF)cc3)c2c1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.37
MLNR O43193 5/20 0.36
PPARG P37231 1/20 0.35
GPBAR1 Q8TDU6 3/20 0.34
RET P07949 2/20 0.34
KCNH2 Q12809 2/20 0.33
PTPN1 P18031 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
MLYCD O95822 1/20 0.32

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
SCHEMBL15718266 0.90 MCHR1 (0.38) GPBAR1KCNH2
SCHEMBL16375021 0.85 KCNH2 (0.44) GPBAR1RETKCNH2
SCHEMBL15764707 0.85 MLNR (0.41) MLNRRET
SCHEMBL15717802 0.85 MCHR1 (0.37) GPBAR1KCNH2
SCHEMBL15764710 0.84 MLNR (0.40) MLNRPPARGRETKCNH2
SCHEMBL17309060 0.84 MAPK14 (0.38) MLNRRET
SCHEMBL15764709 0.82 GRIN1 (0.36) MLNR
SCHEMBL15764752 0.81 CAMKK1 (0.36) MLNRPPARGRETKCNH2
SCHEMBL15762387 0.81 MCHR1 (0.38) GPBAR1KCNH2MLYCD
SCHEMBL15764753 0.79 MLNR (0.42) MLNRRETKCNH2

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-20160333012-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS AG (CH) 2016-11-17 US disclosed
US-20150011522-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES IRM LLC (BM) 2015-01-08 US disclosed
US-8871754-B2 Compounds and compositions for the treatment of parasitic diseases IRM LLC (BM) 2014-10-28 US disclosed
US-20140155367-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES NOVARTIS AG (CH) 2014-06-05 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 (3 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-20150011522-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES MAPT, CYP11B1, CYP11B2 CSF1R 3201/4885MLNR 2852/4885PPARG 2463/4885
US-20140155367-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES MAPT, CYP11B1, CYP11B2 CSF1R 3201/4885MLNR 2852/4885PPARG 2463/4885
US-20160333012-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES MAPT, CYP11B1, CYP11B2 CSF1R 3201/4885MLNR 2852/4885PPARG 2463/4885

“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.