SCHEMBL14725755

SCHEMBL14725755

c1cncc(-c2cc3cc4c(cc(-c5cccnc5)c5cc6c(cc54)sc4ccccc46)cc3c3cc4sc5ccccc5c4cc23)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 11/20 0.55
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GPR84 Q9NQS5 1/20 0.41
CYP2A6 P11509 1/20 0.40
CYP11B2 P19099 10/20 0.40
HIPK2 Q9H2X6 1/20 0.40
ALOX5 P09917 1/20 0.38
P4HTM Q9NXG6 1/20 0.37
CYP17A1 P05093 3/20 0.37
CYP19A1 P11511 2/20 0.37
DYRK1A Q13627 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
GPR3 P46089 1/20 0.37
CYP3A4 P08684 2/20 0.36

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
SCHEMBL16472915 0.97 CYP11B1 (0.55) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL14725747 0.94 CYP11B1 (0.48) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL16472863 0.91 CYP11B1 (0.46) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL16472669 0.90 CYP11B1 (0.45) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL16472832 0.88 CYP11B1 (0.45) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL16472717 0.85 CYP11B1 (0.41) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL16472934 0.85 CYP11B1 (0.45) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL14725745 0.84 GPR3 (0.45) RAB9AALOX5GPR3
SCHEMBL16472762 0.83 CYP11B1 (0.41) CYP11B1NPC1RAB9AGPR84CYP2A6
SCHEMBL16472899 0.82 CYP11B1 (0.42) CYP11B1NPC1RAB9AGPR84CYP11B2

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-9255084-B2 Heterocyclic compound and organic light-emitting device containing the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-02-09 US disclosed
US-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-02-28 US disclosed
US-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-02-28 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-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME TRPC1, TRPC4, TRPC6 CYP11B1 887/4885NPC1 1953/4885RAB9A 1964/4885

“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.