SCHEMBL2444359

SCHEMBL2444359

CC(=O)c1ccc(C2CCC(C(C)=O)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
CYP2C9 P11712 1/20 0.44
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
MAPT P10636 4/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 2/20 0.42
AKR1C3 P42330 1/20 0.41
AKR1C1 Q04828 1/20 0.41
ESR2 Q92731 1/20 0.40
KMT2A Q03164 4/20 0.39
HPGD P15428 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HSD17B1 P14061 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
SCHEMBL3222423 0.90 HDAC8 (0.50) RAB9ANPC1CYP2C9HDAC8HDAC6
SCHEMBL10787825 0.84 CYP2C9 (0.48) RAB9ANPC1CYP2C9HDAC8HDAC6
SCHEMBL27997984 0.84 CYP2C9 (0.48) RAB9ANPC1CYP2C9HDAC8HDAC6
SCHEMBL22816106 0.83 ESR2 (0.57) RAB9ANPC1CYP2C9HDAC8HDAC6
SCHEMBL15043523 0.83 NPC1 (0.47) RAB9ANPC1CYP2C9MAPTLMNA
SCHEMBL14877966 0.83 ESR2 (0.60) RAB9ANPC1CYP2C9HDAC8HDAC6
SCHEMBL469036 0.82 HDAC8 (0.61) RAB9ANPC1CYP2C9HDAC8HDAC6
SCHEMBL4801277 0.82 NPC1 (0.44) RAB9ANPC1CYP2C9HDAC8HDAC6
SCHEMBL12302179 0.82 GSK3B (0.47) RAB9ANPC1CYP2C9MAPTLMNA
SCHEMBL3219203 0.81 MAPT (0.50) RAB9ANPC1CYP2C9MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112341320-A Novel synthesis method of p- (trans-4-hydroxycyclohexyl) phenol 烟台丰鲁精细化工有限责任公司 2021-02-09 CN claimed
CN-112341320-A Novel synthesis method of p- (trans-4-hydroxycyclohexyl) phenol 烟台丰鲁精细化工有限责任公司 2021-02-09 CN disclosed
US-9617473-B2 Switch element comprising a liquid-crystalline medium MERCK PATENT GMBH (DE) 2017-04-11 US disclosed
US-9617473-B2 Switch element comprising a liquid-crystalline medium MERCK PATENT GMBH (DE) 2017-04-11 US disclosed
US-9120779-B2 Inhibitors of HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2015-09-01 US disclosed
US-9120779-B2 Inhibitors of HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2015-09-01 US disclosed
EP-2774927-A1 Inhibitors of HCV NS5A Presidio Pharmaceuticals, Inc. (US) 2014-09-10 EP disclosed
US-20130155338-A1 SWITCH ELEMENT COMPRISING A LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-06-20 US disclosed
EP-2423294-A1 Switch element comprising a liquid-crystalline medium Merck Patent GmbH (DE) 2012-02-29 EP disclosed
EP-2373168-A1 INHIBITORS OF HCV NS5A Presidio Pharmaceuticals, Inc. (US) 2011-10-12 EP disclosed
US-20110237579-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2011-09-29 US disclosed
US-20110237579-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2011-09-29 US disclosed
WO-2010065681-A1 INHIBITORS OF HCV NS5A PRESIDIO PHARMACEUTICALS, INC. (US) 2010-06-10 WO disclosed
US-7303695-B2 Process for producing optically active liquid crystalline polymer compound NIPPON OIL CORPORATION (JP) 2007-12-04 US disclosed
US-7303695-B2 Process for producing optically active liquid crystalline polymer compound NIPPON OIL CORPORATION (JP) 2007-12-04 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-20110237579-A1 INHIBITORS OF HCV NS5A MAVS, HAVCR2, EIF2AK2 RAB9A 1607/4885NPC1 368/4885CYP2C9 3426/4885

“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.