SCHEMBL17070996

SCHEMBL17070996

CC1(C)c2ccccc2-c2cc3c4ccccc4c4cc5c6ccccc6n(-c6ccccn6)c5cc4c3cc21

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 2/20 0.32
▸ CYP17A1 P05093 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31

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
SCHEMBL18062316 0.94 MAT2A (0.34) MAT2ACYP17A1CYP1A2
SCHEMBL17228848 0.93 MAT2A (0.34) MAT2ACYP17A1CYP1A2
SCHEMBL802466 0.93 MAT2A (0.34) MAT2ACYP17A1CYP1A2
SCHEMBL802173 0.88 MAT2A (0.37) MAT2ACYP17A1CYP1A2
SCHEMBL17988938 0.87 MAT2A (0.34) MAT2ACYP17A1CYP1A2
SCHEMBL17071042 0.86 KDM4E (0.31) MAT2A
SCHEMBL17070998 0.84 HTR3A (0.33) —
SCHEMBL17245833 0.83 MAT2A (0.36) MAT2ACYP17A1CYP1A2
SCHEMBL17070988 0.82 KDM4E (0.45) —
SCHEMBL16999735 0.82 CYP17A1 (0.30) MAT2ACYP17A1CYP1A2

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-20150255731-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-09-10 — — US disclosed
US-20150255731-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-09-10 — — US disclosed
Send feedback