SCHEMBL19086997

SCHEMBL19086997

Cc1nc(C(C)C)[nH]c1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.34
HSD17B10 Q99714 2/20 0.34
LMNA P02545 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.33
PDE2A O00408 1/20 0.31
HPGD P15428 2/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7976026 0.81 KDM4E (0.35) KDM4EHSD17B10LMNASCN10AHPGD
SCHEMBL14511649 0.73 MAPT (0.37) KDM4EHSD17B10HPGDPOLBMAPT
SCHEMBL19087003 0.72 PDE2A (0.35) KDM4EHSD17B10LMNAPDE2A
SCHEMBL3787517 0.70 KDM4E (0.35) KDM4EHSD17B10LMNAHPGDALDH1A1
SCHEMBL17788668 0.69 KDM4E (0.40) KDM4EHSD17B10LMNAHPGDPOLB
SCHEMBL22210589 0.69 KDM4E (0.37) KDM4EHSD17B10LMNASCN10APDE2A
SCHEMBL798499 0.69 KDM4E (0.34) KDM4EHSD17B10LMNAHPGDALDH1A1
SCHEMBL21937453 0.66 SCN10A (0.39) KDM4EHSD17B10LMNASCN10APDE2A
SCHEMBL22210591 0.65 KDM4E (0.51) KDM4EHSD17B10LMNASCN10AHPGD
SCHEMBL17449485 0.65 KDM4E (0.37) KDM4EHSD17B10LMNASCN10APDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION 2017-07-06 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-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS PIK3CG, PIK3CD, PIK3CB KDM4E 2506/4885HSD17B10 3403/4885LMNA 3680/4885

“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.