SCHEMBL2231035

SCHEMBL2231035

CCC(CC)c1ccccc1P

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
LMNA P02545 1/20 0.33
GPR84 Q9NQS5 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
CCR5 P51681 1/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30

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
Hydrochloric Acid SCHEMBL7930534 0.98 TSHR (0.39) TSHRLMNANOS3NOS1NOS2
Bromide SCHEMBL7932453 0.98 TSHR (0.39) TSHRLMNA
SCHEMBL11427752 0.82 FFAR1 (0.34) TSHRGPR84
SCHEMBL9734906 0.82 TSHR (0.48) TSHRLMNAGPR84GABRA1GABRB2
Iodide SCHEMBL11698660 0.80 CYSLTR2 (0.33) TSHRGPR84
SCHEMBL9204533 0.79 TSHR (0.59) TSHRGABRA1GABRB2
SCHEMBL4242747 0.77 HTR2A (0.45) TSHRLMNAGPR84
SCHEMBL2697178 0.73 TSHR (0.41) TSHRLMNAGPR84GABRA1GABRB2
SCHEMBL31538069 0.73 ESR1 (0.50) TSHRLMNA
SCHEMBL2971289 0.73 TSHR (0.41) TSHRLMNAGPR84GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839816-B1 The preparation of sulfur-containing organosilicon compounds GOODYEAR TIRE & RUBBER (US) 2004-04-28 EP claimed
EP-0794186-B1 The preparation of sulfur-containing organosilicon compounds GOODYEAR TIRE & RUBBER (US) 2003-05-28 EP claimed
US-6465670-B2 SURFACE TREATMENT USING ORGANOSILICON COMPOUND, SOLVENT AND PHASE TRANSFER CATALYST THE GOODYEAR TIRE & RUBBER COMPANY 2002-10-15 US claimed
US-20020022085-A1 Preparation of surface modified silica GOODYEAR TIRE & RUBBER COMPANY, THE 2002-02-21 US claimed
US-6172251-B1 USING ORGANOSILICON COMPOUNDS THE GOODYEAR TIRE & RUBBER COMPANY 2001-01-09 US claimed
EP-0839816-A1 The preparation of sulfur-containing organosilicon compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1998-05-06 EP claimed
EP-0794186-A1 The preparation of sulfur-containing organosilicon compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1997-09-10 EP claimed
US-5663396-A Preparation of sulfur-containing organosilicon compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1997-09-02 US claimed
US-5583245-A Preparation of sulfur-containing organosilicon compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1996-12-10 US claimed
US-5468893-A Preparation of sulfur-containing organosilicon compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1995-11-21 US claimed
US-5405985-A Preparation of sulfur-containing organosilicon compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1995-04-11 US claimed
US-4433164-A HYDROHALIDE; PALLADIUM CATALYST; AMMONIUM, PHOSPHONIUM OR ARSONIUM COMPOUND RHONE-POULENC INDUSTRIES (FR) 1984-02-21 US claimed
US-4225497-A ACID CATALYSTS FOR IMIDATION RHONE-POULENC INDUSTRIES (FR) 1980-09-30 US claimed
CN-113795896-A Composite for rare earth bonded magnet, method for producing rare earth bonded magnet, and resin composition 昭和电工材料株式会社 2021-12-14 CN disclosed
CN-113785000-A Resin particle mixture 昭和电工材料株式会社 2021-12-10 CN disclosed
WO-2020225884-A1 RESIN PARTICLE MIXTURE 昭和電工マテリアルズ株式会社 2020-11-12 WO disclosed
EP-0031784-A2 Process for preparing ethyl carboxylates from their lower homologues RHONE-POULENC CHIMIE DE BASE (FR) 1981-07-08 EP disclosed
EP-0022735-A1 Process for the preparation of acetaldehyde RHONE-POULENC CHIMIE DE BASE (FR) 1981-01-21 EP disclosed
EP-0022038-A1 Process for the homologation of methanol RHONE-POULENC CHIMIE DE BASE (FR) 1981-01-07 EP disclosed
US-4225497-A ACID CATALYSTS FOR IMIDATION RHONE-POULENC INDUSTRIES (FR) 1980-09-30 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-20020022085-A1 Preparation of surface modified silica OSTC, SAMM50, SSRP1 TSHR 3413/4885LMNA 690/4885GPR84 4051/4885

“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.