SCHEMBL170839

SCHEMBL170839

C1=C(c2ccccc2)c2ccccc2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
MAPK1 P28482 2/20 0.39
HTR6 P50406 1/20 0.38
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP3A4 P08684 1/20 0.37
PTPN1 P18031 2/20 0.36
PTPRC P08575 1/20 0.36
PTPRF P10586 1/20 0.36
CDC25B P30305 1/20 0.36
CYP17A1 P05093 1/20 0.36
BACE1 P56817 1/20 0.36
PRCP P42785 1/20 0.35
CASP3 P42574 1/20 0.35

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
SCHEMBL29598333 1.00 ALDH1A1 (0.39) ALDH1A1MAPK1HTR6NPC1MAPT
SCHEMBL6198719 0.85 ALDH1A1 (0.43) ALDH1A1MAPK1HTR6NPC1MAPT
SCHEMBL9441562 0.84 CYP3A4 (0.54) HTR6NPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL10977883 0.84 IDO1 (0.35) ALDH1A1MAPK1HTR6NPC1MAPT
SCHEMBL28814401 0.82 ALDH1A1 (0.33) ALDH1A1NPC1MAPTRAB9AHPGD
SCHEMBL27346062 0.81 ALDH1A1 (0.42) ALDH1A1MAPK1HTR6NPC1MAPT
SCHEMBL14259333 0.79 CYP3A4 (0.57) MAPK1NPC1MAPTRAB9AKDM4E
SCHEMBL18763972 0.79 S1PR1 (0.38) ALDH1A1NPC1RAB9AKDM4ECYP3A4
SCHEMBL30143246 0.79 S1PR1 (0.38) ALDH1A1NPC1RAB9AKDM4ECYP3A4
SCHEMBL9329744 0.79 HSD17B1 (0.44) KDM4ECYP3A4HSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3013886-B1 THERMAL INSULATION MATERIA INC (US) 2025-03-26 EP claimed
EP-2961778-B1 METAL CARBENE OLEFIN METATHESIS TWO CATALYST COMPOSITION MATERIA INC (US) 2025-02-26 EP claimed
EP-3016991-B1 LIQUID MOLDING COMPOSITIONS MATERIA INC (US) 2024-06-12 EP claimed
CN-116601185-A Olefin composition comprising hydrocarbon resin 马特里亚公司 2023-08-15 CN claimed
US-20220017449-A1 SYNTHESIS OF CONJUGATED DIENE PHEROMONES AND RELATED COMPOUNDS HORIZON TECHNOLOGY FINANCE CORPORATION 2022-01-20 US claimed
CN-113272267-A Synthesis of conjugated diene pheromones and related compounds 普罗维维公司 2021-08-17 CN claimed
US-10619003-B2 Functionalized linear and cyclic polyolefins CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2020-04-14 US claimed
US-10030131-B2 Pneumatic object provided with a gastight layer containing a thermoplastic elastomer and a thermoplastic COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2018-07-24 US claimed
US-20180127539-A1 FUNCTIONALIZED LINEAR AND CYCLIC POLYOLEFINS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-05-10 US claimed
EP-3099654-B1 SYNTHETIC METHOD UNIV COURT UNIV ST ANDREWS (GB) 2018-05-09 EP claimed
EP-2516548-A1 PNEUMATIC OBJECT PROVIDED WITH A GAS-TIGHT LAYER COMPRISING A MIXTURE OF A THERMOPLASTIC ELASTOMER AND A BUTYL RUBBER Compagnie Générale des Etablissements Michelin (FR) 2012-10-31 EP claimed
EP-2516547-A1 INFLATABLE ARTICLE PROVIDED WITH A GASTIGHT LAYER BASED ON A BLEND OF A THERMOPLASTIC ELASTOMER AND OF A PARTIALLY CROSSLINKED BUTYL RUBBER Compagnie Générale des Etablissements Michelin (FR) 2012-10-31 EP claimed
WO-2012004332-A2 INFLATABLE ARTICLE PROVIDED WITH GAS-IMPERMEABLE LAYER BASED ON A BLEND OF A BUTYL RUBBER AND A THERMOPLASTIC ELASTOMER SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2012-01-12 WO claimed
WO-2011141466-A1 PNEUMATIC OBJECT PROVIDED WITH A GASTIGHT LAYER CONTAININGA THERMOPLASTIC ELASTOMER AND A THERMOPLASTIC SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2011-11-17 WO claimed
WO-2011131560-A1 INFLATABLE OBJECT PROVIDED WITH A GAS-TIGHT LAYER CONTAINING A THERMOPLASTIC ELASTOMER AND A HYDROCARBON-BASED RESIN SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2011-10-27 WO claimed
WO-2011076800-A1 PNEUMATIC OBJECT PROVIDED WITH A GAS-TIGHT LAYER COMPRISING A MIXTURE OF A THERMOPLASTIC ELASTOMER AND A BUTYL RUBBER SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2011-06-30 WO claimed
WO-2011076801-A1 INFLATABLE ARTICLE PROVIDED WITH A GASTIGHT LAYER BASED ON A BLEND OF A THERMOPLASTIC ELASTOMER AND OF A PARTIALLY CROSSLINKED BUTYL RUBBER SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2011-06-30 WO claimed
WO-2011009910-A1 PNEUMATIC OBJECT PROVIDED WITH A GASTIGHT LAYER MADE OF A THERMOPLASTIC ELASTOMER AND LAMELLAR FILLER SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2011-01-27 WO claimed
EP-1127051-A2 TRICYCLIC PYRAZOLE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-08-29 EP claimed
WO-2000027822-A2 TRICYCLIC PYRAZOLE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-05-18 WO 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-20220017449-A1 SYNTHESIS OF CONJUGATED DIENE PHEROMONES AND RELATED COMPOUNDS PTMS, CHRNE, CHRNA7 ALDH1A1 1211/4885MAPK1 776/4885HTR6 3748/4885

“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.