SCHEMBL11679201

SCHEMBL11679201

CC(CCl)CC(=O)c1ccc2c(c1)Cc1cc(C(=O)CC(C)CCl)ccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.51
▸ MAPT P10636 3/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ HSD17B1 P14061 1/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ SRD5A2 P31213 1/20 0.43
▸ KCNH2 Q12809 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HTR2C P28335 2/20 0.38
▸ HTR2B P41595 2/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ ADRA1D P25100 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ HTR7 P34969 1/20 0.38
▸ ADRA1A P35348 1/20 0.38
▸ ADRA1B P35368 1/20 0.38
▸ POLB P06746 2/20 0.37
▸ SLC1A3 P43003 1/20 0.37
▸ SLC1A2 P43004 1/20 0.37

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
SCHEMBL11679519 0.88 MAPT (0.49) RAB9AMAPTNPC1HSD17B1KMT2A
SCHEMBL11677033 0.82 MAPT (0.42) RAB9AMAPTNPC1HSD17B1KMT2A
SCHEMBL11679626 0.79 MAPT (0.58) RAB9AMAPTNPC1HSD17B1SRD5A2
SCHEMBL11678574 0.78 KDM4E (0.54) RAB9AMAPTNPC1KMT2AKCNH2
Hydrochloric Acid SCHEMBL31070035 0.78 MAPT (0.50) RAB9AMAPTNPC1HSD17B1KMT2A
SCHEMBL11677514 0.77 MAPT (0.53) RAB9AMAPTNPC1HSD17B1KMT2A
SCHEMBL11675968 0.76 L3MBTL1 (0.58) RAB9AMAPTNPC1KMT2AKDM4E
SCHEMBL11677470 0.74 RAB9A (0.53) RAB9AMAPTNPC1HSD17B1SRD5A2
SCHEMBL10965128 0.74 MAPT (0.53) RAB9AMAPTNPC1HSD17B1KMT2A
SCHEMBL11678805 0.73 L3MBTL1 (0.54) RAB9AMAPTNPC1HSD17B1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4064347-A Bis-basic ketones of fluorene and fluorenone RICHARDSON-MERRELL INC. (US) 1977-12-20 — — US disclosed
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