SCHEMBL5655094

SCHEMBL5655094

Cc1cccc(C(=O)c2ccc(F)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B14 Q9BPX1 3/20 0.49
P2RX7 Q99572 1/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
GBA1 P04062 1/20 0.48
TP53 P04637 1/20 0.48
GRM5 P41594 3/20 0.46
LTA4H P09960 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
CYP1A2 P05177 1/20 0.41
TACR3 P29371 1/20 0.41
CYP2C19 P33261 1/20 0.41
CNR2 P34972 2/20 0.41

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
SCHEMBL8151883 0.87 HSD17B14 (0.55) HSD17B14NPC1LTA4HMEN1KMT2A
SCHEMBL11454469 0.84 CNR2 (0.58) P2RX7NPC1RAB9AGRM5MEN1
SCHEMBL23366592 0.83 CNR2 (0.59) P2RX7NPC1RAB9AGBA1GRM5
SCHEMBL22061926 0.82 P2RX7 (0.55) HSD17B14P2RX7NPC1RAB9AGRM5
SCHEMBL1958309 0.81 P2RX7 (0.62) P2RX7NPC1RAB9AGBA1GRM5
SCHEMBL11876573 0.80 MAPT (0.50) P2RX7NPC1RAB9AGBA1GRM5
SCHEMBL10627250 0.79 HSD17B14 (0.49) HSD17B14NPC1RAB9ATP53LTA4H
SCHEMBL1873600 0.79 HSD17B14 (0.49) HSD17B14NPC1GRM5LTA4HMEN1
SCHEMBL15197224 0.78 NPC1 (0.53) HSD17B14P2RX7NPC1RAB9AGBA1
SCHEMBL11828622 0.76 P2RX7 (0.49) HSD17B14P2RX7RAB9AGRM5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262185-B2 Benzazepine derivative, process for producing the same, and use TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2007-08-28 US disclosed
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-25 US disclosed
EP-1422228-A1 BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Chemical Industries, Ltd. (JP) 2004-05-26 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-20040235822-A1 Benzazepine derivative, process for producing the same, and use CYP1B1, CYP1A1, CYP2E1 HSD17B14 1414/4885P2RX7 1824/4885NPC1 2059/4885

“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.