SCHEMBL19065415

SCHEMBL19065415

COc1cncc(-c2cc(-c3nc4ccccc4[nH]3)ncn2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.52
RAB9A P51151 6/20 0.52
KDM4E B2RXH2 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
ALDH1A1 P00352 3/20 0.52
PKM P14618 3/20 0.52
RUNX1 Q01196 1/20 0.46
METAP2 P50579 2/20 0.46
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR3 P22607 1/20 0.46
PDE10A Q9Y233 2/20 0.45
ADORA3 P0DMS8 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
HPGD P15428 2/20 0.44
TP53 P04637 2/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44

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
Trifluoroacetic Acid SCHEMBL31181671 0.90 PDE10A (0.45) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL19065638 0.83 NPC1 (0.51) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL17566744 0.80 WNT1 (0.71) FGFR1WNT1TGFBR1CLK2CLK3
SCHEMBL17969330 0.79 NPC1 (0.52) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL18438571 0.77 CLK2 (0.64) WNT1TGFBR1CLK2CLK3DYRK1A
Trifluoroacetic Acid SCHEMBL19065532 0.75 PDE10A (0.48) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL18009967 0.73 PIK3CG (0.51) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL18010003 0.73 SMN1; SMN2 (0.50) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL2283643 0.72 KDR (0.51) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL2278458 0.72 KMO (0.53) NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1

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
EP-3792256-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS Incyte Corporation (US) 2021-03-17 EP claimed
EP-3400221-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS Incyte Corporation (US) 2018-11-14 EP claimed
WO-2017120194-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION (US) 2017-07-13 WO claimed
US-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION 2017-07-06 US claimed
EP-3792256-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS Incyte Corporation (US) 2021-03-17 EP disclosed
EP-3400221-B1 PYRAZOL / IMIDAZOL SUBSTITUTED PYRIDINES AS PI3K-GAMMA INHIBITORS INCYTE CORP (US) 2020-08-26 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-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS PIK3CG, PIK3CD, PIK3CB NPC1 4055/4885RAB9A 895/4885KDM4E 2506/4885

“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.