SCHEMBL2802318

SCHEMBL2802318

CCOC(=O)NC1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.60
THRB P10828 1/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NPSR1 Q6W5P4 1/20 0.52
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MAPT P10636 1/20 0.50
CYP3A4 P08684 1/20 0.50
EPHX2 P34913 1/20 0.50
HTT P42858 1/20 0.49

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
SCHEMBL8393517 1.00 EPHX1 (0.60) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL20350198 1.00 EPHX1 (0.60) EPHX1THRBATML3MBTL1NPSR1
Hydrochloric Acid SCHEMBL4535556 0.98 EPHX1 (0.58) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL1053459 0.98 EPHX1 (0.57) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL8396643 0.94 EPHX1 (0.53) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL8408096 0.91 EPHX1 (0.61) EPHX1THRBATML3MBTL1NPSR1
SCHEMBL7788916 0.90 SMYD3 (0.47) EPHX1THRBATML3MBTL1ALDH1A1
SCHEMBL18380884 0.90 SMYD3 (0.47) EPHX1THRBATML3MBTL1ALDH1A1
SCHEMBL7470486 0.90
Acrylic Acid SCHEMBL28954511 0.88 EPHX1 (0.54) EPHX1THRBATML3MBTL1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118225933-A Method for detecting content of cyclohexyl carbamate by adopting single-four-level rod mass spectrometer 天津力生制药股份有限公司 2024-06-21 CN claimed
CN-108732290-A A kind of detection method of Glipizide genotoxicity impurity 威海迪素制药有限公司 2018-11-02 CN claimed
CN-105473145-A Compositions and therapeutic methods for accelerated plaque regression RESVERLOGIX CORP 2016-04-06 CN claimed
US-12234402-B2 Mesogen compounds TRANSITIONS OPTICAL, LTD. (IE) 2025-02-25 US disclosed
CN-118225933-A Method for detecting content of cyclohexyl carbamate by adopting single-four-level rod mass spectrometer 天津力生制药股份有限公司 2024-06-21 CN disclosed
CN-118225933-A Method for detecting content of cyclohexyl carbamate by adopting single-four-level rod mass spectrometer 天津力生制药股份有限公司 2024-06-21 CN disclosed
CN-113166649-B Mesogenic compounds 光学转变有限公司 2024-05-28 CN disclosed
US-20230383187-A1 Mesogen Compounds TRANSITIONS OPTICAL, LTD. (IE) 2023-11-30 US disclosed
US-RE49686-E1 Nitrogen-containing heterocyclic compound and use of same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-10 US disclosed
US-11773326-B2 Mesogen compounds TRANSITIONS OPTICAL, LTD. (IE) 2023-10-03 US disclosed
CN-112020493-B Method for producing urethane and method for producing isocyanate 旭化成株式会社 2023-04-21 CN disclosed
US-4582822-A ANIMAL FEED ADDITIVES ELI LILLY AND COMPANY (US) 1986-04-15 US disclosed
US-4542213-A BLUE COLOR FOR POLYAMIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-09-17 US disclosed
EP-0124971-A1 Acid dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-14 EP disclosed
US-4430505-A UREA, PRIMARY AMINES, ALCOHOLS BAYER AKTIENGESELLSCHAFT (DE) 1984-02-07 US disclosed
EP-0083096-A2 Production of urethane compounds Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1983-07-06 EP disclosed
US-4386033-A BOILING, CONDENSATION OF VAPORS, CIRCULATION; SEPARATION BAYER AKTIENGESELLSCHAFT (DE) 1983-05-31 US disclosed
US-4294925-A FERMENTATION, AEROBIC PROCESSES HOFFMANN-LA ROCHE INC. (US) 1981-10-13 US disclosed
US-4263427-A REACTING HYDROXYL WITH ISOCYANATE TO OBTAIN ANTIBIOTICS HOFFMANN-LA ROCHE INC. (US) 1981-04-21 US disclosed
US-4260562-A HYDROGENATION OF A KETOXIME, PLATINUM, MINERAL ACID BASF AKTIENGESELLSCHAFT (DE) 1981-04-07 US disclosed