SCHEMBL547869

SCHEMBL547869

O=Cc1ccc(C2CCCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC1 Q13547 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
HSP90AA1 P07900 1/20 0.43
ESR2 Q92731 3/20 0.43
HAO1 Q9UJM8 1/20 0.42
TRIM24 O15164 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41
GLA P06280 1/20 0.41
HIF1A Q16665 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL10740141 1.00 HTT (0.44) HTTLMNAHDAC8HDAC6HDAC1
SCHEMBL11678689 1.00 HTT (0.44) HTTLMNAHDAC8HDAC6HDAC1
SCHEMBL3438249 0.98 HDAC1 (0.46) HTTLMNAHDAC8HDAC6HDAC1
SCHEMBL3243130 0.96 ESR2 (0.46) HTTLMNAHDAC8HDAC6HDAC1
SCHEMBL4453448 0.89 KMT2A (0.39) HTTLMNAHDAC8HDAC6HDAC1
SCHEMBL21752934 0.89 HAO1 (0.48) HTTLMNAHDAC8HDAC6HDAC1
SCHEMBL741455 0.89 CYP2A6 (0.44) ALDH1A1KDM4EESR2TRIM24TRIM33
SCHEMBL19218160 0.89 CYP2A6 (0.44) ALDH1A1KDM4EESR2TRIM24TRIM33
SCHEMBL21386555 0.83 CYP3A4 (0.45) SMN1; SMN2ALDH1A1KDM4EKMT2ATDP1
SCHEMBL2320728 0.83 NPC1 (0.47) ALDH1A1KDM4EKMT2ATDP1GAA

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 441 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101437784-B 4- (4-alkylcyclohexyl) benzaldehyde MITSUBISHI GAS CHEMICAL CO 2013-08-28 CN claimed
EP-2017252-B1 PREPARATION OF 4-(4-ALKYLCYCLOHEXYL)BENZALDEHYDE MITSUBISHI GAS CHEMICAL CO (JP) 2012-12-19 EP claimed
US-7777081-B2 4-(4-alkylcyclohexyl)benzaldehyde MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-08-17 US claimed
CN-101437784-A 4- (4-alkylcyclohexyl) benzaldehyde MITSUBISHI GAS CHEMICAL CO (JP) 2009-05-20 CN claimed
US-20090118547-A1 4-(4-ALKYLCYCLOHEXYL)BENZALDEHYDE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-05-07 US claimed
EP-2017252-A1 4-(4-ALKYLCYCLOHEXYL)BENZALDEHYDE Mitsubishi Gas Chemical Company, Inc. (JP) 2009-01-21 EP claimed
US-20060058351-A1 Novel ligands that modulate LXR-type receptors and cosmetic/pharmaceutical applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-03-16 US claimed
EP-1599447-A1 LIGANDS THAT MODULATE LXR-TYPE RECEPTORS Galderma Research & Development, S.N.C. (FR) 2005-11-30 EP claimed
WO-2004076418-A1 LIGANDS THAT MODULATE LXR-TYPE RECEPTORS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-09-10 WO claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
US-4582903-A Synthesis of unsaturated hydantoins with an inexpensive catalyst STAUFFER CHEMICAL COMPANY (US) 1986-04-15 US claimed
US-4345072-A Process for the production of 5-arylidene hydantoins (B) DEGUSSA AG (DE) 1982-08-17 US claimed
WO-2024189504-A1 BROAD - SPECTRUM ANTI VIRAL COMPOUNDS FOUNDATION FOR NEGLECTED DISEASE RESEARCH (IN) 2024-09-19 WO disclosed
CN-114423742-B Benzotriazole-based compound, light absorber and resin composition 三井化学株式会社 2024-05-28 CN disclosed
CN-115947714-B Synthesis method of photochemical caching agent 上海泰辉生物科技有限公司 2024-05-14 CN disclosed
US-4000130-A INDOLE DYES, POLYACRYLONITRILE BAYER AKTIENGESELLSCHAFT (DT) 1976-12-28 US disclosed
US-3966678-A Maleic anhydride-polyaldimine prepolymers RHONE-POULENC S.A. (FR) 1976-06-29 US disclosed
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090118547-A1 4-(4-ALKYLCYCLOHEXYL)BENZALDEHYDE CYP4F3, AFF4, COXFA4 HTT 1658/4885LMNA 1572/4885HDAC8 3742/4885
US-20060058351-A1 Novel ligands that modulate LXR-type receptors and cosmetic/pharmaceutical applications thereof NR1H2, NR1H3, RXRG HTT 3542/4885LMNA 1835/4885HDAC8 787/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.