SCHEMBL324342

SCHEMBL324342

O=C(c1ccccc1)C1CC1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.56
CPB1 P15086 1/20 0.56
KMT2A Q03164 3/20 0.54
MGLL Q99685 2/20 0.54
MEN1 O00255 2/20 0.54
HSD11B1 P28845 1/20 0.54
SLC18A3 Q16572 2/20 0.53
MCL1 Q07820 1/20 0.52
SRD5A2 P31213 1/20 0.52
KCNH2 Q12809 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50

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
SCHEMBL18428493 1.00 HTR2A (0.56) HTR2ACPB1KMT2AMGLLMEN1
Bicarbonate SCHEMBL11468689 0.98 HTR2A (0.54) HTR2ACPB1KMT2AMGLLMEN1
Acetic Acid SCHEMBL2762930 0.93 HTR2A (0.51) HTR2ACPB1KMT2AMGLLMEN1
SCHEMBL407216 0.93 NPC1 (0.52) HTR2ACPB1KMT2AMGLLMEN1
SCHEMBL3515355 0.93 NPC1 (0.52) HTR2ACPB1KMT2AMGLLMEN1
SCHEMBL439217 0.93 NPC1 (0.52) HTR2ACPB1KMT2AMGLLMEN1
SCHEMBL26883 0.91 SLC18A3 (0.51) HTR2ACPB1KMT2AMGLLMEN1
SCHEMBL965420 0.91 SRD5A2 (0.63) HTR2ACPB1KMT2AMGLLMEN1
SCHEMBL3113279 0.91 SRD5A2 (0.58) HTR2ACPB1KMT2AMGLLMEN1
SCHEMBL2570762 0.89 HTR2A (0.49) HTR2ACPB1KMT2AMGLLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115584014-A Ladder-shaped polymer material with heat-resisting and fluorescent characteristics and preparation method thereof 大连理工大学 2023-01-10 CN claimed
US-8680290-B2 Isoxazoline derivatives and their use as herbicides SYNGENTA LIMITED (GB) 2014-03-25 US claimed
US-20100179343-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-07-15 US claimed
CN-101663256-A Process for producing optically active cyanohydrin derivative AGENCY SCIENCE TECH & RES 2010-03-03 CN claimed
EP-1789401-B1 ISOXAZOLINE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA LTD (GB) 2010-03-03 EP claimed
US-20090270299-A1 Composition for removing protective layer in fabrication of MEMS and method for removing same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-10-29 US claimed
US-7473669-B2 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones, and their use as fungicides DOW AGROSCIENCES LLC (US) 2009-01-06 US claimed
WO-2008121074-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-10-09 WO claimed
EP-1881966-A2 SUBSTITUTED 4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONES, 1,2,4-TRIANZIN-6-ONES, AND THEIR USE AS FUNGICIDES Dow AgroSciences LLC (US) 2008-01-30 EP claimed
WO-2006119400-A2 SUBSTITUTED 4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONES, 1,2,4-TRIANZIN-6-ONES, AND THEIR USE AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2006-11-09 WO claimed
US-5763627-A Process for preparing cyclopropyl alkyl ketones and 4,5-dihydroalkyfurans HUELS AKTIENGESELLSCHAFT (DE) 1998-06-09 US claimed
EP-0643732-B1 VINYLAROMATIC BLOCK COPOLYMERS BEING HIGHLY SENSITIVE TO RADIATION CURING AND COMPOSITIONS CONTAINING THEM SHELL INT RESEARCH (NL) 1996-08-28 EP claimed
EP-0643732-A1 VINYLAROMATIC BLOCK COPOLYMERS BEING HIGHLY SENSITIVE TO RADIATION CURING AND COMPOSITIONS CONTAINING THEM. SHELL INT RESEARCH (NL) 1995-03-22 EP claimed
CN-1079479-A To high responsive vinyl aromatic (co) hydrocarbon block copolymer of radiation curing and the composition that contains this multipolymer SHELL INT RESEARCH (NL) 1993-12-15 CN claimed
WO-1993024547-A1 VINYLAROMATIC BLOCK COPOLYMERS BEING HIGHLY SENSITIVE TO RADIATION CURING AND COMPOSITIONS CONTAINING THEM SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1993-12-09 WO claimed
EP-0563251-A1 UV/EB CURABLE BUTYL COPOLYMERS FOR LITHOGRAPHIC AND CORROSION-RESISTANT COATING APPLICATIONS EXXON CHEMICAL PATENTS INC. (US) 1993-10-06 EP claimed
EP-0563271-A1 UV/EB CURABLE BUTYL COPOLYMERS FOR COATING APPLICATIONS EXXON CHEMICAL PATENTS INC. (US) 1993-10-06 EP claimed
WO-1992011322-A2 UV/EB CURABLE BUTYL COPOLYMERS FOR LITHOGRAPHIC AND CORROSION-RESISTANT COATING APPLICATIONS EXXON CHEMICAL PATENTS INC. (US) 1992-07-09 WO claimed
WO-1992011295-A1 UV/EB CURABLE BUTYL COPOLYMERS FOR COATING APPLICATIONS EXXON CHEMICAL PATENTS INC. (US) 1992-07-09 WO claimed
EP-0296452-A1 Azolylmethylcyclopropyl-carbinol derivatives BAYER AG (DE) 1988-12-28 EP claimed

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-20100179343-A1 METHOD OF PRODUCING AN OPTICALLY ACTIVE CYANOHYDRIN DERIVATIVE TDO2, AOX1, DAO HTR2A 3196/4885CPB1 152/4885KMT2A 1029/4885

“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.