SCHEMBL9288307

SCHEMBL9288307

CCCC1CCC(C2CCC(C(=O)OCC)CC2)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 6/20 0.43
POLB P06746 1/20 0.40
TLR4 O00206 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PPM1B O75688 1/20 0.39
PTPN1 P18031 1/20 0.39
PPP1CC P36873 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL8215658 1.00 MAPT (0.45) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL10850819 1.00 MAPT (0.45) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL8991772 0.95 MAPT (0.49) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL8991774 0.95 MAPT (0.49) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL3189910 0.93 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL10479620 0.93 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL10479615 0.93 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL3189915 0.93 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL10844426 0.90 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL10844424 0.90 MAPT (0.47) MAPTMEN1KMT2AALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112961042-B Synthesis method of trans-4- (trans-4' -alkyl cyclohexyl) cyclohexyl formaldehyde 惠泽化学科技(濮阳)有限公司 2024-05-31 CN disclosed
CN-112961042-A Synthesis method of trans-4- (trans-4' -alkylcyclohexyl) cyclohexyl formaldehyde 惠泽化学科技(濮阳)有限公司 2021-06-15 CN disclosed
EP-2607451-B1 Liquid crystalline medium MERCK PATENT GMBH (DE) 2019-01-23 EP disclosed
US-8388861-B2 Liquid crystal compound and liquid crystal mixture JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2013-03-05 US disclosed
US-8388861-B2 Liquid crystal compound and liquid crystal mixture JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2013-03-05 US disclosed
US-20120132854-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL MIXTURE JIANGSU HECHENG CHEMICAL MATERIALS CO., LTD. (CN) 2012-05-31 US disclosed
US-20120132854-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL MIXTURE JIANGSU HECHENG CHEMICAL MATERIALS CO., LTD. (CN) 2012-05-31 US disclosed
US-4617140-A Bicyclohexyl derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-14 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 (1 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-20120132854-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL MIXTURE CPNE4, LEO1, NCAPD3 MAPT 2362/4885MEN1 616/4885KMT2A 4473/4885

“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.