SCHEMBL745116

SCHEMBL745116

Cc1nc(N/N=C(/N=N/c2ccccc2)c2ccccc2)sc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.49
NPC1 O15118 8/20 0.49
PKM P14618 2/20 0.49
MAOA P21397 5/20 0.47
MAOB P27338 5/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 6/20 0.44
GAA P10253 4/20 0.44
MAPT P10636 7/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 2/20 0.42
TDP1 Q9NUW8 4/20 0.41
KDM4E B2RXH2 3/20 0.41
HTT P42858 3/20 0.41
PTBP1 P26599 1/20 0.39
HSP90AA1 P07900 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL21838458 1.00 RAB9A (0.49) RAB9ANPC1PKMMAOAMAOB
SCHEMBL21838460 1.00 RAB9A (0.49) RAB9ANPC1PKMMAOAMAOB
SCHEMBL30220799 1.00 RAB9A (0.49) RAB9ANPC1PKMMAOAMAOB
SCHEMBL745117 1.00 RAB9A (0.49) RAB9ANPC1PKMMAOAMAOB
SCHEMBL21097694 0.80 HSP90AA1 (0.55) RAB9ANPC1PKML3MBTL1MEN1
SCHEMBL11327597 0.80 HSP90AA1 (0.55) RAB9ANPC1PKML3MBTL1MEN1
SCHEMBL11332710 0.80 HSP90AA1 (0.55) RAB9ANPC1PKML3MBTL1MEN1
SCHEMBL8924537 0.77 RAB9A (0.50) RAB9ANPC1PKMMAOAMAOB
SCHEMBL2619262 0.77 RAB9A (0.50) RAB9ANPC1PKMMAOAMAOB
SCHEMBL745118 0.77 RAB9A (0.50) RAB9ANPC1PKMMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140038305-A1 ARTICLES AND METHODS FOR THE DETECTION AND QUANTIFICATION OF ULTRAVIOLET LIGHT PROPPER MANUFACTURING COMPANY, INC. (US) 2014-02-06 US claimed
US-20260130966-A1 NOVEL THERAPEUTICS FOR PARASITIC INFECTION UNIV SOUTH FLORIDA (US) 2026-05-14 US disclosed
EP-4289830-B1 NLRP3 INFLAMMASOME SMALL-MOLECULE INHIBITOR FOR TREATMENT OF ALZHEIMER'S DISEASE UNIV AJOU IND ACADEMIC COOP FOUND (KR) 2026-04-08 EP disclosed
US-12558354-B2 Tumor necrosis factor alpha (TNF-alpha) small molecule inhibitor AJOU UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2026-02-24 US disclosed
US-20260021127-A1 pH REGULATING HYDROGELS THAT NEUTRALIZE CANCER CELL ENVIRONMENT ACIDOSIS AND INCREASE CHEMOTHERAPY EFFICACY UNIV BROWN (US) 2026-01-22 US disclosed
US-12409187-B2 PH regulating hydrogels that neutralize cancer cell environment acidosis and increase chemotherapy efficacy BROWN UNIVERSITY (US) 2025-09-09 US disclosed
US-20240358746-A1 METHOD OF OBTAINING STABLE SUSPENSIONS OF HETEROCRYSTALS OF TITANIUM DIOXIDE OR PARTICLES OF SILICON DIOXIDE AND STABLE SUSPENSIONS OBTAINED BY THIS METHOD FOR INITIATION OF ACTIVE FORM OF OXYGEN IN BODY AT USE IN MEDICAL FORMS KURKAYEV ABDULA (HU) 2024-10-31 US disclosed
US-20240309045-A1 NLRP3 INFLAMMASOME INHIBITORY PEPTIDE FOR TREATMENT OF INFLAMMATORY DISEASES AJOU UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2024-09-19 US disclosed
US-20240132458-A1 NLRP3 INFLAMMASOME SMALL-MOLECULE INHIBITOR FOR TREATMENT OF ALZHEIMER'S DISEASE AJOU UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2024-04-25 US disclosed
WO-2024081969-A1 NOVEL THERAPEUTICS FOR PARASITIC INFECTION UNIVERSITY OF SOUTH FLORIDA (US) 2024-04-18 WO disclosed
EP-1653988-A2 LEUKOCYTE INTERNALIZED PEPTIDE-DRUG CONJUGATES THE UNIVERSITY OF KANSAS (US) 2006-05-10 EP disclosed
US-20050202399-A1 Method of assay by oxidation-reduction reaction with formazan ARKRAY, INC. (JP) 2005-09-15 US disclosed
EP-1515143-A1 METHOD OF ASSAY BY OXIDATION-REDUCTION REACTION WITH FORMAZAN ARKRAY, Inc. (JP) 2005-03-16 EP disclosed
WO-2005002516-A2 LEUKOCYTE INTERNALIZED PEPTIDE-DRUG CONJUGATES UNIVERSITY OF KANSAS (US) 2005-01-13 WO disclosed
US-20040037775-A1 Leukocyte internalized peptide-drug conjugates KANSAS, UNIVERSITY OF 2004-02-26 US disclosed
US-20030220250-A1 Angiopoietin-1 in the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2003-11-27 US disclosed
WO-2003068165-A2 ANGIOPOIETIN-1 IN THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2003-08-21 WO disclosed
WO-1999006040-A9 METHOD OF TREATING DISEASE USING A TOCOTRIENOL AND ALPHA-LIPOIC ACID OR DERIVATIVES OR AN ESTER THEREOF BERRY CHRISTOPHER J (TH) 1999-04-29 WO disclosed
WO-1999006040-A1 METHOD OF TREATING DISEASE USING A TOCOTRIENOL AND ALPHA-LIPOIC ACID OR DERIVATIVES OR AN ESTER THEREOF BERRY CHRISTOPHER J (TH) 1999-02-11 WO disclosed
WO-1996013160-A1 USE OF UROKINASE-TYPE PLASMINOGEN ACTIVATORS TO INHIBIT HIV INFECTIVITY NEW ENGLAND DEACONESS HOSPITAL (US) 1996-05-09 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 (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-12558354-B2 Tumor necrosis factor alpha (TNF-alpha) small molecule inhibitor TNF, TNFRSF1A, TNFRSF9 RAB9A 2163/4885NPC1 2482/4885PKM 4748/4885
US-20260130966-A1 NOVEL THERAPEUTICS FOR PARASITIC INFECTION SLC10A1, SLC10A2, ABCB11 RAB9A 631/4885NPC1 200/4885PKM 481/4885
US-20240132458-A1 NLRP3 INFLAMMASOME SMALL-MOLECULE INHIBITOR FOR TREATMENT OF ALZHEIMER'S DISEASE NLRP3, NLRP1, BACE1 RAB9A 1796/4885NPC1 337/4885PKM 4442/4885
US-20040037775-A1 Leukocyte internalized peptide-drug conjugates CD47, TAP1, CD74 RAB9A 1029/4885NPC1 433/4885PKM 4366/4885
US-20260021127-A1 pH REGULATING HYDROGELS THAT NEUTRALIZE CANCER CELL ENVIRONMENT ACIDOSIS AND INCREASE CHEMOTHERAPY EFFICACY FIBP, CD44, COL14A1 RAB9A 1531/4885NPC1 4209/4885PKM 1051/4885

“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.