SCHEMBL19051122

SCHEMBL19051122

CC(C)c1ccc(N(c2ccccc2)c2cc3c(-c4ccccc4)cc(N(c4ccccc4)c4ccc(C(C)C)cc4)c4ccc5c(-c6ccccc6)ccc2c5c34)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.35
CRHR1 P34998 2/20 0.33
KIF11 P52732 1/20 0.32
PTGS1 P23219 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
LMNA P02545 3/20 0.32
PTGS2 P35354 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
FABP2 P12104 1/20 0.32
TSHR P16473 1/20 0.32
AKR1C4 P17516 1/20 0.32
ADRA2B P18089 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2C P28335 1/20 0.32
DRD3 P35462 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
AKR1C1 Q04828 1/20 0.32

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
SCHEMBL12576978 0.95 METAP2 (0.38) METAP2CRHR1KIF11PTGS1MEN1
SCHEMBL25636247 0.95 METAP2 (0.38) METAP2CRHR1KIF11PTGS1MEN1
SCHEMBL24488550 0.90 METAP2 (0.35) METAP2CRHR1KIF11MEN1KMT2A
SCHEMBL24041239 0.90 METAP2 (0.35) METAP2CRHR1KIF11HPGDCNR1
SCHEMBL23921030 0.90 METAP2 (0.35) METAP2CRHR1KIF11MEN1KMT2A
SCHEMBL19080428 0.88 CRHR1 (0.36) METAP2CRHR1KIF11MEN1KMT2A
SCHEMBL12577224 0.88 CNR2 (0.33) METAP2CRHR1KIF11MEN1KMT2A
SCHEMBL12577068 0.87 AKR1C3 (0.39) METAP2CRHR1KIF11MEN1KMT2A
SCHEMBL24050251 0.87 METAP2 (0.36) METAP2CRHR1KIF11PTGS1LMNA
SCHEMBL25492381 0.85 CRHR1 (0.32) METAP2CRHR1LMNAMAPTGAA

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-20170186969-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-29 US disclosed
US-20170186969-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-29 US disclosed