SCHEMBL9154528

SCHEMBL9154528

CCCCCC1CCC(c2nnc(-c3ccc(OCCCCCCCCCCCC4CC4)cc3)s2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.51
MAPT P10636 2/20 0.51
LMNA P02545 1/20 0.51
KDM4E B2RXH2 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
XIAP P98170 1/20 0.42
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
HTR1B P28222 1/20 0.39
HTR2B P41595 1/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC6 Q9UBN7 1/20 0.39
RARB P10826 3/20 0.38
GAA P10253 1/20 0.38
NR5A1 Q13285 1/20 0.38

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
SCHEMBL9154524 1.00 RAB9A (0.51) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL8742558 1.00 RAB9A (0.51) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL8742439 0.96 RAB9A (0.51) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL9670595 0.93 RAB9A (0.45) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL9668828 0.93 RAB9A (0.45) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL9681788 0.91 RAB9A (0.43) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL9681782 0.91 RAB9A (0.43) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL7505222 0.87 RAB9A (0.54) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL9589366 0.86 RAB9A (0.53) RAB9AMAPTLMNAKDM4ESMN1; SMN2
SCHEMBL9345353 0.86 RAB9A (0.53) RAB9AMAPTLMNAKDM4ESMN1; SMN2

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-5407599-A Cyclopropylaklyl or -alkenyl or heterocyclic compounds, process for their preparation and their use in liquid-crystalline mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1995-04-18 US disclosed
EP-0318423-B1 Liquid crystalline cyclopropyl alkyl or alkenylhetero rings, process for their preparation and their use in liquid-crystal mixtures HOECHST AG (DE) 1995-02-01 EP disclosed
EP-0318423-A2 Liquid crystalline cyclopropyl alkyl or alkenylhetero rings, process for their preparation and their use in liquid-crystal mixtures HOECHST AKTIENGESELLSCHAFT (DE) 1989-05-31 EP disclosed