Cyclohexane

Cyclohexane

SCHEMBL9420602

C1CCCCC1.CC1=CC(=O)CC(C)(C)C1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
HPGD P15428 2/20 0.50
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 7/20 0.48
PAX8 Q06710 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
LMNA P02545 4/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TP53 P04637 1/20 0.41
GAA P10253 3/20 0.41
KDM4E B2RXH2 3/20 0.41
TSHR P16473 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
GLA P06280 1/20 0.40
ALOX15 P16050 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40

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
SCHEMBL7102666 0.95 ALDH1A1 (0.52) MAPTHPGDNPSR1ALDH1A1KMT2A
SCHEMBL22522 0.95 ALDH1A1 (0.52) MAPTHPGDNPSR1ALDH1A1KMT2A
Water SCHEMBL9637163 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A
SCHEMBL28684183 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A
Water SCHEMBL28863261 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A
Ammonia Solution, Strong SCHEMBL7735826 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A
Ammonia Solution, Strong SCHEMBL1984334 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A
Ammonia Solution, Strong SCHEMBL10613596 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A
SCHEMBL271129 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A
SCHEMBL11132973 0.93 ALDH1A1 (0.50) MAPTHPGDNPSR1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118339852-A Deformation structure, wearable device and use method of wearable device 华为技术有限公司 2024-07-12 CN disclosed
CN-105452215-B Fatty amides based on lactams or amino acids and use as organogelators 阿科玛法国公司 2018-08-28 CN disclosed
US-5278275-A Polyesterurethane copolymer comprising one tricyclic molecular TOYO BOSEKI KABUSHIKI KAISHA 1994-01-11 US disclosed
US-5137972-A Crosslinked polyurethane; protective coatings BASF CORPORATION (US) 1992-08-11 US disclosed