SCHEMBL7967927

SCHEMBL7967927

COCCNC(=O)c1ccc(F)cc1F

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
HPGD P15428 2/20 0.50
KDM4E B2RXH2 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPK14 Q16539 1/20 0.50
POLB P06746 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPK1 P28482 1/20 0.49
CES2 O00748 1/20 0.49
CES1 P23141 1/20 0.49
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HDAC3 O15379 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
BRAF P15056 1/20 0.46
ACKR3 P25106 1/20 0.46

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
Acetic Acid SCHEMBL6453507 0.96 KDM4E (0.50) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL14316370 0.86 ESRRG (0.59) HPGDKDM4EMAPK1MEN1KMT2A
SCHEMBL12124297 0.86 MEN1 (0.56) HPGDKDM4EPOLBMAPK1SMN1; SMN2
SCHEMBL24100547 0.85 HPGD (0.66) NPC1RAB9AHPGDKDM4EMAPK1
SCHEMBL5636281 0.84 NPC1 (0.46) NPC1RAB9AHPGDKDM4EHSD17B10
SCHEMBL13753140 0.84 L3MBTL1 (0.54) NPC1RAB9AHPGDPOLBTDP1
SCHEMBL23698347 0.82 HPGD (0.49) NPC1RAB9AHPGDKDM4EMAPK1
SCHEMBL27288206 0.82 HPGD (0.46) HPGDKDM4EMAPK1MAPTSMN1; SMN2
SCHEMBL5636971 0.82 ALPL (0.55) NPC1RAB9AKDM4ECES2CES1
SCHEMBL12462063 0.82 HDAC3 (0.54) NPC1RAB9ACES2CES1HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 NPC1 708/4885RAB9A 3358/4885HPGD 190/4885

“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.