SCHEMBL3397538

SCHEMBL3397538

c1ccc2c(-n3nccn3)cccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.58
MAPK1 P28482 2/20 0.58
POLB P06746 1/20 0.50
ALDH1A1 P00352 7/20 0.49
HSD17B10 Q99714 5/20 0.49
KDM4E B2RXH2 4/20 0.49
HPGD P15428 4/20 0.49
MEN1 O00255 3/20 0.49
MAPT P10636 3/20 0.49
KMT2A Q03164 3/20 0.49
ALOX15 P16050 2/20 0.49
CASP1 P29466 2/20 0.49
APAF1 O14727 1/20 0.49
TP53 P04637 1/20 0.49
CASP7 P55210 1/20 0.49
USP2 O75604 1/20 0.46
RAB9A P51151 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL12957439 0.77 ALDH1A1 (0.70) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL6212184 0.75 NPC1 (0.46) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL11785056 0.75 ALDH1A1 (0.54) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL859717 0.74 MAPK1 (1.00) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL11783497 0.74 ALDH1A1 (0.50) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL9055547 0.73 MAPK1 (0.52) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL8990319 0.72 POLB (0.63) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL18770820 0.72 POLB (0.63) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL30285929 0.72 POLB (0.63) NPC1MAPK1POLBALDH1A1HSD17B10
SCHEMBL30987382 0.71 MEN1 (0.43) NPC1MAPK1POLBALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9193896-B2 Composition having enhanced corrosion resistance and pH buffering property for antifreeze liquid or coolant KUKDONG JEYEN COMPANY LIMITED (KR) 2015-11-24 US claimed
US-20140223929-A1 COMPOSITION HAVING ENHANCED CORROSION RESISTANCE AND PH BUFFERING PROPERTY FOR ANTIFREEZE LIQUID OR COOLANT KUKDONG JEYEN COMPANY LIMITED (KR) 2014-08-14 US claimed
EP-2759582-A1 COMPOSITION HAVING ENHANCED CORROSION RESISTANCE AND PH BUFFERING PROPERTY FOR ANTIFREEZE LIQUID OR COOLANT Kukdong Jeyen Company Limited (KR) 2014-07-30 EP claimed
US-20090289215-A1 ANTIFREEZE COOLANT COMPOSITION HAVING HIGH HEAT-OXIDATION RESISTANCE HYUNDAI MOTOR COMPANY (KR) 2009-11-26 US claimed
US-6096236-A GLYCOL COOLANT AND HEPTANOIC ACID AND HEXANOIC ACID CCI CO., LTD. (JP) 2000-08-01 US claimed
US-5961875-A Antifreeze/coolant composition containing cinnamic acid CCI CO., LTD. (JP) 1999-10-05 US claimed
JP-8253459-A None JP disclosed
WO-2024130300-A1 A METHOD FOR THE PRODUCTION OF EDGE FUNCTIONALISED GRAPHENE Sicona Battery Technologies Pty Ltd (AU) 2024-06-27 WO disclosed
WO-2023115143-A1 EDGE FUNCTIONALISED GRAPHENE THERMAL NANOFLUIDS Sicona Battery Technologies Pty Ltd (AU) 2023-06-29 WO disclosed
US-11549044-B2 Antifreezing coolant composition not including glycol HYUNDAI MOTOR COMPANY (KR) 2023-01-10 US disclosed
US-20210189214-A1 ANTIFREEZING COOLANT COMPOSITION NOT INCLUDING GLYCOL KD FINECHEM CO. LTD. (KP) 2021-06-24 US disclosed
EP-2832814-B1 LIQUID COOLANT COMPOSITION CCI CORP (JP) 2019-05-08 EP disclosed
EP-2759583-B1 COMPOSITION FOR ANTIFREEZE LIQUID OR COOLANT HAVING SUPERIOR CAVITATION EROSION- AND GAP CORROSION-RESISTANCE EFFECT KUKDONG JEYEN CO LTD (KR) 2018-03-21 EP disclosed
EP-0864628-A1 Antifreeze/coolant composition CCI Co. Limited (JP) 1998-09-16 EP disclosed
EP-0827996-A1 Cavitation damage inhibitive antifreeze/coolant composition CCI Co. Limited (JP) 1998-03-11 EP disclosed
JP-H08253459-A IMPROVED ECONOMIC PRODUCTION OF 1,2,3-TRIAZOLES SYNPHAR LAB INC 1996-10-01 JP disclosed
US-4212672-A CYANINE SENSITIZER DYE, SULFONIC ACID-SUBSTITUTED HETEROCYCLIC COMPOUND, POLYOXYALKYLENE OXIDE FUJI PHOTO FILM CO., LTD. (JP) 1980-07-15 US disclosed
US-4199360-A DISSOLVING METHINE DYE IN PRESENCE OF RED SHIFT COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1980-04-22 US disclosed
US-4138266-A SULFO-SUBSTITUTED CYANINE AND RED SHIFT TRIAZOLE DYES FUJI PHOTO FILM CO., LTD. (JP) 1979-02-06 US disclosed
US-4060570-A BUTYL RUBBER OR POLYBUTENE ADHESIVE, OIL ABSORBENT FILLER THIOKOL CORPORATION (US) 1977-11-29 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 (2 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-20210189214-A1 ANTIFREEZING COOLANT COMPOSITION NOT INCLUDING GLYCOL CA1, CA3, TREH NPC1 4212/4885MAPK1 505/4885POLB 1624/4885
US-11549044-B2 Antifreezing coolant composition not including glycol CA1, CA3, TREH NPC1 4212/4885MAPK1 505/4885POLB 1624/4885

“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.