SCHEMBL48321

SCHEMBL48321

CCSc1cc(SCC)c(N)c(C)c1N

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.36
HSP90AA1 P07900 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
NOS3 P29474 1/20 0.30
NOS2 P35228 1/20 0.30
ABCB1 P08183 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
SCHEMBL6910768 0.92 AOC3 (0.32) AOC3
SCHEMBL9179742 0.89 ALDH1A1 (0.36) AOC3HSP90AA1ALDH1A1MAPTHTT
SCHEMBL5522764 0.87 ALDH1A1 (0.33) AOC3ALDH1A1MAPTHTT
SCHEMBL8540338 0.83 AOC3 (0.38) AOC3HSP90AA1ALDH1A1MAPT
SCHEMBL6905535 0.82 KMT2A (0.38) ALDH1A1MAPT
SCHEMBL14776649 0.81 AOC3 (0.32) AOC3
SCHEMBL6909596 0.81 SKP2 (0.38) AOC3HTTNOS2
SCHEMBL1797285 0.81
SCHEMBL6911625 0.80 TLR8 (0.46) ALDH1A1
SCHEMBL6910764 0.79 AOC3 (0.39) AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3083744-B1 POLYURETHANE/POLYUREAS COVESTRO LLC (US) 2020-04-22 EP claimed
US-7786243-B2 Polyurea and polyurethane compositions for golf equipment ACUSHNET COMPANY (US) 2010-08-31 US claimed
US-20090149278-A1 Polyurea and Polyurethane Compositions for Golf Equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2009-06-11 US claimed
US-20090137344-A1 GOLF BALL COMPOSITIONS WITH IMPROVED TEMPERATURE PERFORMANCE, HEAT RESISTANCE, AND RESILIENCY JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2009-05-28 US claimed
US-7517943-B2 Golf ball layer compositions formed from oxirane functional endcapped polymers ACUSHNET COMPANY (US) 2009-04-14 US claimed
US-7429629-B2 Golf ball layers formed of polyurethane-based and polyurea-based compositions incorporating block copolymers ACUSHNET COMPANY (US) 2008-09-30 US claimed
US-20070197724-A1 Golf ball layers formed of polyurethane-based and polyurea-based compositions incorporating block copolymers ACUSHNET COMPANY 2007-08-23 US claimed
US-20070129510-A1 Golf ball layer compositions formed from oxirane functional endcapped polymers ACUSHNET COMPANY 2007-06-07 US claimed
US-7217764-B2 Golf ball layers formed of polyurethane-based and polyurea-based compositions incorporating block copolymers ACUSHNET COMPANY (US) 2007-05-15 US claimed
US-6964621-B2 Water resistant polyurea elastomers for golf equipment ACUSHNET COMPANY (US) 2005-11-15 US claimed
US-6939907-B2 Golf balls comprising highly-neutralized acid polymers ACUSHNET COMPANY (US) 2005-09-06 US claimed
US-6894098-B2 Golf balls comprising highly-neutralized acid polymers ACUSHNET COMPANY (US) 2005-05-17 US claimed
US-20050009638-A1 Golf ball layers formed of polyurethane-based and polyurea-based compositions incorporating block copolymers JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-01-13 US claimed
US-20040209708-A1 Water resistant polyurea elastomers for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-10-21 US claimed
US-20030158352-A1 Golf balls comprising highly-neutralized acid polymers JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2003-08-21 US claimed
EP-0591059-B1 Use of sulfur-containing metaphenylenediamines for dyeing keratinic fibers and new sulfur-containing metaphenylenediamines OREAL (FR) 1998-04-15 EP claimed
EP-0591059-A1 Use of sulfur-containing metaphenylenediamines for dyeing keratinic fibers and new sulfur-containing metaphenylenediamines L'OREAL (FR) 1994-04-06 EP claimed
US-20260085147-A1 SOLVENT-BORNE COATING COMPOSITIONS COMPRISING A WATER-DISPERSIBLE POLYISOCYANATE PPG INDUSTRIES OHIO, INC. (US) 2026-03-26 US disclosed
EP-0329821-A2 Polyhydroxyalkane/aromatic diamine chain extenders ETHYL CORPORATION (US) 1989-08-30 EP disclosed
US-4786656-A FOR POLYURETHANES ETHYL CORPORATION (US) 1988-11-22 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-20260085147-A1 SOLVENT-BORNE COATING COMPOSITIONS COMPRISING A WATER-DISPERSIBLE POLYISOCYANATE PARG, PUF60, SRM AOC3 963/4885HSP90AA1 3264/4885ALDH1A1 2671/4885

“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.