SCHEMBL6299934

SCHEMBL6299934

Cc1ccc(CNc2ccc(N)cc2)s1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.57
MAPT P10636 3/20 0.57
RAB9A P51151 3/20 0.57
ALDH1A1 P00352 2/20 0.57
ALOX15 P16050 2/20 0.57
ALOX12 P18054 2/20 0.57
TP53 P04637 2/20 0.57
NPC1 O15118 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
NPSR1 Q6W5P4 1/20 0.57
PRMT6 Q96LA8 1/20 0.53
KDM4E B2RXH2 3/20 0.49
THRB P10828 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.42
KDM4C Q9H3R0 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL2718601 0.81 TP53 (0.61) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL5693381 0.80 PRMT6 (0.47) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL6297638 0.79 FFAR1 (0.56) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL5682277 0.77 GAA (0.54) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL5362798 0.77 GAA (0.54) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL5682278 0.74 ALDH1A1 (0.52) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL5350063 0.74 CA1 (0.56) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL14071630 0.74 MAOA (0.42) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL14869697 0.74 PRMT6 (0.52) GAAMAPTRAB9AALDH1A1ALOX15
SCHEMBL5713825 0.73 GAA (0.49) GAAMAPTRAB9AALDH1A1ALOX15

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887281-B2 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds WELLA AKTIENGESELLSCHAFT (DE) 2005-05-03 US claimed
US-20050015898-A1 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2005-01-27 US claimed
US-6953791-B2 Dipeptide derivatives PFIZER, INC. (US) 2005-10-11 US disclosed
US-6951850-B2 Dipeptide derivatives PFIZER, INC. (US) 2005-10-04 US disclosed
US-6924280-B2 Dipeptide derivatives PFIZER INC. (US) 2005-08-02 US disclosed
US-6887281-B2 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds WELLA AKTIENGESELLSCHAFT (DE) 2005-05-03 US disclosed
US-6849097-B2 N-heteroarylmethyl-p-phnylendiamine derivatives and compounds containing oxidationcoloring agents WELLA AKTIENGESELLSCHAFT (DE) 2005-02-01 US disclosed
US-20050015898-A1 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2005-01-27 US disclosed
US-RE38524-E1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2004-06-01 US disclosed
EP-1313724-B1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS WELLA AG (DE) 2004-04-28 EP disclosed
US-20040009984-A1 Increasing levels of endogenous growth hormone, especially treating osterporosis, aging frailty or congestive heart failure CARPINO PHILIP ALBERT (US) 2004-01-15 US disclosed
EP-1313724-A1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS Wella Aktiengesellschaft (DE) 2003-05-28 EP disclosed
US-20030070240-A1 N-heteroarylmethyl-p-phnylendiamine derivatives and compounds containing oxidationcoloring agents HFC PRESTIGE INTERNATIONAL OPERATIONS SWITZERLAND SÀRL (CH) 2003-04-17 US disclosed
US-6525047-B2 Which are growth hormone secretogogues and increase the level of endogenous growth hormone; treating osteoporosis, congestive heart failure, frailty associated with aging, obesity; accelerating bone fracture repair PFIZER INC. 2003-02-25 US disclosed
US-6432945-B1 Dipeptide derivatives PFIZER INC. 2002-08-13 US disclosed
US-20020042415-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2002-04-11 US disclosed
WO-2002018365-A1 N-HETEROARYLMETHYL-P-PHENYLENDIAMINE DERIVATIVES AND COMPOUNDS CONTAINING OXIDATION COLOURING AGENTS WELLA AKTIENGESELLSCHAFT (DE) 2002-03-07 WO disclosed
US-20010041703-A1 Dipeptide derivatives CARPINO PHILIP ALBERT (US) 2001-11-15 US disclosed
US-6251902-B1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2001-06-26 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 (5 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-20040009984-A1 Increasing levels of endogenous growth hormone, especially treating osterporosis, aging frailty or congestive heart failure GHSR, GHRHR, GIPR GAA 1947/4885MAPT 4844/4885RAB9A 4040/4885
US-20030070240-A1 N-heteroarylmethyl-p-phnylendiamine derivatives and compounds containing oxidationcoloring agents PNMT, PAH, CYP2E1 GAA 2861/4885MAPT 2997/4885RAB9A 3784/4885
US-20020042415-A1 Dipeptide derivatives GIPR, GHRHR, GHSR GAA 3583/4885MAPT 4862/4885RAB9A 4472/4885
US-20010041703-A1 Dipeptide derivatives GIPR, GHRHR, GHSR GAA 3543/4885MAPT 4845/4885RAB9A 4339/4885
US-20050015898-A1 N-heteroarylmethyl-p-phenylenediamine derivatives as well as oxidation dyeing agents containing these compounds TYR, PNMT, DDT GAA 2903/4885MAPT 3455/4885RAB9A 3783/4885

“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.