SCHEMBL2173229

SCHEMBL2173229

CC(C)(N)c1cccc(O)c1C(C)(C)N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
TDP1 Q9NUW8 4/20 0.46
TSHR P16473 3/20 0.46
CA2 P00918 3/20 0.43
TRPA1 O75762 2/20 0.38
ATM Q13315 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
ALOX15 P16050 7/20 0.35
LMNA P02545 5/20 0.35
HSD17B10 Q99714 5/20 0.35
HPGD P15428 4/20 0.35
EGFR P00533 2/20 0.35
FYN P06241 2/20 0.35
MMP9 P14780 2/20 0.35
RECQL P46063 2/20 0.35
CDK2 P24941 2/20 0.35
ADAMTS4 O75173 1/20 0.35
CA1 P00915 1/20 0.35
MMP2 P08253 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
SCHEMBL16728382 0.84 CA2 (0.40) ALDH1A1TDP1TSHRCA2GABRA1
SCHEMBL33426 0.80 ALDH1A1 (0.35) ALDH1A1TDP1TSHRCA2ALOX15
SCHEMBL10692638 0.80 CA2 (0.50) ALDH1A1TDP1TSHRCA2TRPA1
SCHEMBL30626639 0.79 ALDH1A1 (0.65) ALDH1A1TDP1TSHRCA2TRPA1
SCHEMBL141506 0.79 ALDH1A1 (0.65) ALDH1A1TDP1TSHRCA2TRPA1
Ammonia Solution, Strong SCHEMBL9788976 0.78 ALDH1A1 (0.34) ALDH1A1TDP1TSHRALOX15LMNA
SCHEMBL8388477 0.77 TSHR (0.46) ALDH1A1TDP1TSHRCA2TRPA1
SCHEMBL7848673 0.77 TRPA1 (0.37) ALDH1A1TDP1TSHRCA2TRPA1
SCHEMBL1698713 0.77 CA2 (0.64) ALDH1A1TDP1TSHRCA2TRPA1
SCHEMBL10619689 0.76 GABRA1 (0.43) ALDH1A1TDP1TSHRCA2TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11845830-B2 Method for producing a composition comprising a polyurethane with NCO end groups BOSTIK SA (FR) 2023-12-19 US claimed
US-20220018078-A1 Composite System and Method for Pile Construction and Repair SZCZEPANIAK ZBIGNIEW ANDREW (US) 2022-01-20 US claimed
US-10899986-B2 Substituted Mannich base fuel additives, compositions, and methods EVONIK OPERATIONS GMBH (DE) 2021-01-26 US claimed
US-20200308337-A1 METHOD FOR PRODUCING A COMPOSITION COMPRISING A POLYURETHANE WITH NCO END GROUPS BOSTIK SA (FR) 2020-10-01 US claimed
US-10676564-B2 Amidoamine and polyamide curing agents, compositions, and methods EVONIK OPERATIONS GMBH (DE) 2020-06-09 US claimed
EP-3504303-B1 SUBSTITUTED MANNICH BASE FUEL ADDITIVES, COMPOSITIONS, AND METHODS EVONIK OPERATIONS GMBH (DE) 2020-04-01 EP claimed
EP-3411421-B1 AMIDOAMINE AND POLYAMIDE CURING AGENTS, COMPOSITIONS, AND METHODS EVONIK OPERATIONS GMBH (DE) 2019-12-25 EP claimed
EP-3504303-A1 SUBSTITUTED MANNICH BASE FUEL ADDITIVES, COMPOSITIONS, AND METHODS Evonik Degussa GmbH (DE) 2019-07-03 EP claimed
US-20190169515-A1 SUBSTITUTED MANNICH BASE FUEL ADDITIVES, COMPOSITIONS, AND METHODS EVONIK OPERATIONS GMBH (DE) 2019-06-06 US claimed
EP-3411421-A1 AMIDOAMINE AND POLYAMIDE CURING AGENTS, COMPOSITIONS, AND METHODS Evonik Degussa GmbH (DE) 2018-12-12 EP claimed
US-20170218115-A1 AMIDOAMINE AND POLYAMIDE CURING AGENTS, COMPOSITIONS, AND METHODS EVONIK OPERATIONS GMBH (DE) 2017-08-03 US claimed
US-9334409-B2 Curing agent for low temperature cure applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2016-05-10 US claimed
EP-2726531-B1 CURABLE EPOXY RESIN SYSTEMS CONTAINING MIXTURES OF AMINE HARDENERS AND AN EXCESS OF EPOXIDE GROUPS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-07-22 EP claimed
US-20140256853-A1 Curing Agent for Low Temperature Cure Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-11 US claimed
EP-2726531-A1 CURABLE EPOXY RESIN SYSTEMS CONTAINING MIXTURES OF AMINE HARDENERS AND AN EXCESS OF EPOXIDE GROUPS Dow Global Technologies LLC (US) 2014-05-07 EP claimed
US-8513376-B2 Polyamides and amidoamines from selectively modified amine amines AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-08-20 US claimed
WO-2013003202-A1 CURABLE EPOXY RESIN SYSTEMS CONTAINING MIXTURES OF AMINE HARDENERS AND AN EXCESS OF EPOXIDE GROUPS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-01-03 WO claimed
US-8293863-B2 comprising the reaction product of multifunctional amines such as N,N-bis(3-aminopropyl) ethylenediamine, with dimer fatty acids or esters, useful for crosslinking epoxy resins to produce quick-drying coatings, adhesives, floors and composites AIR PRODUCTS AND CHEMICALS, INC. (US) 2012-10-23 US claimed
US-20090259003-A1 Curing Agent For Low Temperature Cure Applications AIR PRODUCTS AND CHEMICALS, INC. (US) 2009-10-15 US claimed
EP-2108668-A1 Curing agent for low temperature cure applications Air Products and Chemicals, Inc. (US) 2009-10-14 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 (4 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-20140256853-A1 Curing Agent for Low Temperature Cure Applications PNMT, PAM, HNMT ALDH1A1 727/4885TDP1 2175/4885TSHR 4743/4885
US-10899986-B2 Substituted Mannich base fuel additives, compositions, and methods H1-2, H1-0, H1-3 ALDH1A1 126/4885TDP1 1691/4885TSHR 4360/4885
US-10676564-B2 Amidoamine and polyamide curing agents, compositions, and methods NAAA, FAAH2, H1-2 ALDH1A1 1227/4885TDP1 1549/4885TSHR 2952/4885
US-20090259003-A1 Curing Agent For Low Temperature Cure Applications PNMT, PAM, HNMT ALDH1A1 727/4885TDP1 2175/4885TSHR 4743/4885

“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.