SCHEMBL17877875

SCHEMBL17877875

N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)-c1ccc(-c3cc(-c4cccnc4)cc(-c4cccnc4)c3)cc1CN(c1ccccc1)C2

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 13/20 0.40
CYP11B1 P15538 10/20 0.40
CYP17A1 P05093 2/20 0.39
FLT3 P36888 2/20 0.38
CYP19A1 P11511 2/20 0.36
MAPK1 P28482 1/20 0.35
CHRNB2 P17787 2/20 0.34
CHRNA5 P30532 2/20 0.34
CHRNA4 P43681 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 1/20 0.34
PIM1 P11309 1/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34

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
SCHEMBL17876225 0.97 CYP11B2 (0.40) CYP11B2CYP11B1CYP17A1FLT3CYP19A1
SCHEMBL17877880 0.96 CYP11B2 (0.41) CYP11B2CYP11B1CYP17A1FLT3CYP19A1
SCHEMBL17877876 0.92 PRKDC (0.32) CYP11B2CYP11B1
SCHEMBL17876265 0.91 CYP11B2 (0.39) CYP11B2CYP11B1CYP17A1CYP19A1CYP1A2
SCHEMBL17877910 0.88 MYC (0.35) CYP11B2CYP11B1FLT3MAPK1CYP1A2
SCHEMBL17877864 0.88 CYP11B2 (0.41) CYP11B2CYP11B1CYP17A1FLT3CYP19A1
SCHEMBL17877726 0.88 CYP11B2 (0.41) CYP11B2CYP11B1CYP17A1FLT3CYP19A1
SCHEMBL17876221 0.87 PIM1 (0.37) CYP11B2CYP11B1CYP17A1CYP19A1MAPK1
SCHEMBL17877877 0.87 PRKDC (0.33) CYP1A2CYP3A4
SCHEMBL17876318 0.87 FLT3 (0.36) CYP11B2CYP11B1FLT3CYP19A1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-03-03 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 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 (2 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-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CRY2, CCNE2 CYP11B2 1374/4885CYP11B1 938/4885CYP17A1 909/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 CYP11B2 1374/4885CYP11B1 938/4885CYP17A1 909/4885

“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.