SCHEMBL1820089

SCHEMBL1820089

C1=CC([Ti]C2C=Cc3ccccc32)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.40
HTR6 P50406 1/20 0.39
SIGMAR1 Q99720 6/20 0.33
KDM4E B2RXH2 2/20 0.32
CYP2D6 P10635 2/20 0.32
BRD4 O60885 1/20 0.32
CCL2 P13500 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CHRM2 P08172 1/20 0.32
CYP3A4 P08684 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
NFKB1 P19838 1/20 0.32
CHRM3 P20309 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32

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
Fluoromethane SCHEMBL8528917 0.94 HTR2A (0.36) HTR2AHTR6SIGMAR1KDM4ECYP2D6
Biphenyl SCHEMBL819251 0.92 ALDH1A1 (0.36) HTR2AHTR6SIGMAR1
SCHEMBL8779530 0.88 HTR2A (0.33) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL6535429 0.87 SIGMAR1 (0.39) HTR2AHTR6SIGMAR1KCNH2HSD17B10
SCHEMBL9075904 0.86 HTR2A (0.38) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL8779476 0.84 HTR6 (0.31) HTR2AHTR6
SCHEMBL8779569 0.82 HTR2A (0.33) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL7764724 0.82 HTR6 (0.41) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL5698322 0.72 HTR2A (0.44) HTR2AHTR6SIGMAR1KDM4ECYP2D6
SCHEMBL31046607 0.70 HTR2A (0.43) HTR2AHTR6SIGMAR1KDM4ECYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700694-B2 Catalyst composition and method for hydrogenating a polymer having a conjugated diene TSRC CORPORATION (TW) 2010-04-20 US claimed
US-20070254802-A1 Catalyst composition and method for hydrogenating a polymer having a conjugated diene TSRC CORPORATION (TW) 2007-11-01 US claimed
US-7186782-B2 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2007-03-06 US claimed
US-20060041079-A1 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION 2006-02-23 US claimed
US-6881797-B2 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2005-04-19 US claimed
US-20040082727-A1 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (CN) 2004-04-29 US claimed
US-5688887-A Reactive, low molecular weight, viscous poly(1-olefins) and copoly(1-olefins) and their method of manufacture AMOCO CORPORATION (US) 1997-11-18 US claimed
EP-0795564-A1 Process for hydrogenation of conjugated diene polymers and catalyst compositions suitable for use therein SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1997-09-17 EP claimed
US-20260103548-A1 PROCESS FOR PRODUCING POLYPROPYLENE-ETHYLENE RANDOM COPOLYMER RESIN WITH SUSTAINABLE REACTOR OPERABILITY W. R. GRACE & CO.-CONN. 2026-04-16 US disclosed
US-20250235842-A1 GAS-PHASE PROCESS FOR MAKING POLYPROPYLENE RANDOM COPOLYMERS W.R. GRACE & CO.-CONN (US) 2025-07-24 US disclosed
US-20250235859-A1 PROCESS FOR PRODUCING A SINGLE SITE CATALYST W.R. GRACE & CO.-CONN. (US) 2025-07-24 US disclosed
US-20250215120-A1 POLYETHYLENE POWDER AND METHOD FOR PRODUCING SAME, AND CATALYST FOR OLEFIN POLYMERIZATION AND METHOD FOR PRODUCING SAME ASAHI KASEI KABUSHIKI KAISHA (JP) 2025-07-03 US disclosed
US-20250205686-A1 SILICA-SUPPORTED POLYOLEFIN CATALYST SYSTEM W. R. GRACE & CO.-CONN. 2025-06-26 US disclosed
EP-4493600-A1 PROCESS FOR PRODUCING HEAT TREATED SUPPORTED ALUMINOXANES IN AN ALIPHATIC SOLVENT USING SOLID ALUMINOXANES W. R. Grace & Co.-Conn (US) 2025-01-22 EP disclosed
US-5925717-A SELECTIVE HYDROGENATION OF POLYMERS WITH TITANIUM CATALYSTS WITH INDENE COMPOUND LIGANDS SHELL OIL COMPANY (US) 1999-07-20 US disclosed
EP-0669346-B1 Solid catalyst components for olefin polymerization and use thereof NIPPON OIL CO LTD (JP) 1998-06-03 EP disclosed
US-5688887-A Reactive, low molecular weight, viscous poly(1-olefins) and copoly(1-olefins) and their method of manufacture AMOCO CORPORATION (US) 1997-11-18 US disclosed
EP-0795564-A1 Process for hydrogenation of conjugated diene polymers and catalyst compositions suitable for use therein SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1997-09-17 EP disclosed
US-5604170-A EFFECTIVE CATALYST SUPPORT SATISFYING CERTAIN REQUISITES: PARTICLE DIAMETER, SPECIFIC SURFACE AREA, PORE VOLUME, SPECIFIC GRAVITY; SUBJECTED TO ULTRASONIC DISINTEGRATION NIPPON OIL COMPANY, LIMITED (JP) 1997-02-18 US disclosed
EP-0669346-A1 Solid catalyst components for olefin polymerization and use thereof NIPPON OIL CO. LTD. (JP) 1995-08-30 EP 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-20260103548-A1 PROCESS FOR PRODUCING POLYPROPYLENE-ETHYLENE RANDOM COPOLYMER RESIN WITH SUSTAINABLE REACTOR OPERABILITY CCT4, PTGER1, TCP1 HTR2A 2913/4885HTR6 2137/4885SIGMAR1 1551/4885

“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.