SCHEMBL2802336

SCHEMBL2802336

O=C(OCCN(CCO)CCO)c1ccccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.63
▸ SCN1A P35498 3/20 0.52
▸ SCN2A Q99250 3/20 0.52
▸ SCN3A Q9NY46 3/20 0.52
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ TSHR P16473 3/20 0.46
▸ LMNA P02545 1/20 0.46
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ SERPINE1 P05121 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42

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
Ethyl Salicylate SCHEMBL27450124 0.86 TSHR (0.59) TDP1SCN1ASCN2ASCN3ANPC1
Detanosal SCHEMBL2110875 0.84 SCN1A (0.68) TDP1SCN1ASCN2ASCN3ATSHR
SCHEMBL9401308 0.84 TDP1 (0.62) TDP1SCN1ASCN2ASCN3ATSHR
SCHEMBL29392370 0.83 TDP1 (0.76) TDP1NPC1RAB9ATSHRLMNA
SCHEMBL15402 0.83 TDP1 (0.76) TDP1NPC1RAB9ATSHRLMNA
Ethylene Glycol SCHEMBL432445 0.83 TDP1 (0.76) TDP1NPC1RAB9ATSHRLMNA
Detanosal SCHEMBL30397539 0.83 SCN1A (0.66) TDP1SCN1ASCN2ASCN3ATSHR
Detanosal SCHEMBL29163805 0.83 SCN1A (0.66) TDP1SCN1ASCN2ASCN3ATSHR
SCHEMBL21705599 0.83 SCN1A (0.51) TDP1SCN1ASCN2ASCN3ATSHR
Methyl Salicylate SCHEMBL155347 0.83 LMNA (0.71) TDP1NPC1TSHRLMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10351523-B2 UV-absorbing compounds with at least one reactive hydrogen ISP INVESTMENTS LLC 2019-07-16 — — US claimed
US-20180099927-A1 UV-ABSORBING COMPOUNDS WITH AT LEAST ONE REACTIVE HYDROGEN ISP INVESTMENTS LLC (US) 2018-04-12 — — US claimed
US-9657228-B2 Performance boosting UV-absorbing compounds ISP INVESTMENTS LLC (US) 2017-05-23 — — US claimed
US-9289631-B2 Polymer-bound UV absorbers in personal care compositions ISP INVESTMENTS INC. (US) 2016-03-22 — — US claimed
US-20160002154-A1 UV-ABSORBING COMPOUNDS WITH AT LEAST ONE REACTIVE HYDROGEN ISP INVESTMENTS INC. (US) 2016-01-07 — — US claimed
US-20150265522-A1 POLYMER-BOUND UV ABSORBERS IN PERSONAL CARE COMPOSITIONS ISP INVESTMENTS INC. (US) 2015-09-24 — — US claimed
US-9044623-B2 Polymer-bound UV absorbers in personal care compositions ISP INVESTMENTS INC. (US) 2015-06-02 — — US claimed
WO-2014149363-A1 UV-ABSORBING COMPOUNDS WITH AT LEAST ONE REACTIVE HYDROGEN ISP INVESTMENTS INC. (US) 2014-09-25 — — WO claimed
US-20140023601-A1 PERFORMANCE BOOSTING UV-ABSORBING COMPOUNDS ISP INVESTMENT INC. (US) 2014-01-23 — — US claimed
US-8557226-B2 Performance-boosting UV-absorbing compounds ISP INVESTMENTS INC. (US) 2013-10-15 — — US claimed
US-20100189661-A1 POLYMER-BOUND UV ABSORBERS IN PERSONAL CARE COMPOSITIONS PHARMACHEM LABORATORIES LLC 2010-07-29 — — US claimed
US-20100183532-A1 Performance-Boosting UV-Absorbing Compounds HERCULES LLC 2010-07-22 — — US claimed
US-10407528-B2 UV-absorbing polymers and formulations thereof ISP INVESTMENTS LLC (US) 2019-09-10 — — US disclosed
US-10351523-B2 UV-absorbing compounds with at least one reactive hydrogen ISP INVESTMENTS LLC 2019-07-16 — — US disclosed
US-20180208695-A1 UV-ABSORBING POLYMERS AND FORMULATIONS THEREOF ISP INVESTMENTS LLC (US) 2018-07-26 — — US disclosed
US-20180099927-A1 UV-ABSORBING COMPOUNDS WITH AT LEAST ONE REACTIVE HYDROGEN ISP INVESTMENTS LLC (US) 2018-04-12 — — US disclosed
WO-2000066576-A1 ISOFLAVONE METABOLITES G.J. CONSULTANTS PTY LTD (AU) 2000-11-09 — — WO disclosed
US-6007797-A Disappearing color sunscreen compositions IPA, LLC (US) 1999-12-28 — — US disclosed
US-5208011-A Octyl methoxycinnamate, oxybenzone and/or octyl salicylate and polymers SUN PHARMACEUTICAL CORP. (US) 1993-05-04 — — US disclosed
WO-1992007587-A1 METHODS AND COMPOSITIONS FOR AMELIORATION OF SKIN WRINKLES NARHEX LIMITED (HK) 1992-05-14 — — WO 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 (8 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-10407528-B2 UV-absorbing polymers and formulations thereof PUF60, UACA, UMPS TDP1 1387/4885SCN1A 3133/4885SCN2A 2697/4885
US-20180208695-A1 UV-ABSORBING POLYMERS AND FORMULATIONS THEREOF PUF60, UACA, UMPS TDP1 1387/4885SCN1A 3133/4885SCN2A 2697/4885
US-20100189661-A1 POLYMER-BOUND UV ABSORBERS IN PERSONAL CARE COMPOSITIONS CUTA, UACA, LAGE3 TDP1 1771/4885SCN1A 1873/4885SCN2A 2150/4885
US-20100183532-A1 Performance-Boosting UV-Absorbing Compounds APOB, ALOX5, RARG TDP1 3510/4885SCN1A 4340/4885SCN2A 3878/4885
US-20150265522-A1 POLYMER-BOUND UV ABSORBERS IN PERSONAL CARE COMPOSITIONS CUTA, UACA, LAGE3 TDP1 1771/4885SCN1A 1873/4885SCN2A 2150/4885
US-10351523-B2 UV-absorbing compounds with at least one reactive hydrogen ERCC1, ERCC4, UNG TDP1 1392/4885SCN1A 3637/4885SCN2A 3956/4885
US-20160002154-A1 UV-ABSORBING COMPOUNDS WITH AT LEAST ONE REACTIVE HYDROGEN ERCC1, ERCC4, UNG TDP1 1392/4885SCN1A 3637/4885SCN2A 3956/4885
US-20180099927-A1 UV-ABSORBING COMPOUNDS WITH AT LEAST ONE REACTIVE HYDROGEN ERCC1, ERCC4, UNG TDP1 1392/4885SCN1A 3637/4885SCN2A 3956/4885

“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.

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