SCHEMBL15780481

SCHEMBL15780481

COCc1nc2c(CO)cccc2n1C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
HTT P42858 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 8/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NPC1 O15118 7/20 0.38
PTGES O14684 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALOX12 P18054 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL14685304 0.89 TSHR (0.45) TSHRHTTNPSR1KMT2ASMN1; SMN2
SCHEMBL7965261 0.82 TLR8 (0.43) TSHRHTTNPSR1KMT2ASMN1; SMN2
SCHEMBL14685285 0.81 TLR7 (0.41) TSHRKMT2ASMN1; SMN2MEN1KDM4E
SCHEMBL14685303 0.79 RAB9A (0.57) KMT2ASMN1; SMN2MEN1TP53RAB9A
SCHEMBL12362614 0.79 DPP4 (0.44) TSHRNPSR1KMT2ASMN1; SMN2MEN1
SCHEMBL14685206 0.77 TP53 (0.43) TSHRSMN1; SMN2TP53RAB9AL3MBTL1
SCHEMBL14685305 0.77 TP53 (0.39) TSHRHTTNPSR1KMT2ASMN1; SMN2
SCHEMBL14685299 0.75 RAB9A (0.50) KMT2ASMN1; SMN2MEN1ALDH1A1TP53
SCHEMBL14685306 0.74 SMN1; SMN2 (0.38) TSHRSMN1; SMN2TP53RAB9AL3MBTL1
SCHEMBL15782104 0.74 RAB9A (0.49) KMT2ASMN1; SMN2MEN1TP53RAB9A

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
EP-2740730-B1 DIBENZOOXEPIN DERIVATIVE KYOWA HAKKO KIRIN CO LTD (JP) 2016-11-16 EP disclosed
US-8969345-B2 Dibenzooxepin derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2015-03-03 US disclosed
US-8969345-B2 Dibenzooxepin derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2015-03-03 US disclosed
US-20140163008-A1 DIBENZOOXEPIN DERIVATIVE KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-06-12 US disclosed
EP-2740730-A1 DIBENZOOXEPIN DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2014-06-11 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-20140163008-A1 DIBENZOOXEPIN DERIVATIVE PPARA, PPARG, PPARD TSHR 234/4885HTT 4217/4885NPSR1 2504/4885

“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.