SCHEMBL19439

SCHEMBL19439

[c]1ncccc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.39
ALDH1A1 P00352 2/20 0.36
NISCH Q9Y2I1 2/20 0.35
MTOR P42345 1/20 0.35
ADK P55263 1/20 0.35
RAB9A P51151 5/20 0.35
NPC1 O15118 4/20 0.35
MAPK1 P28482 1/20 0.35
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2A6 P11509 1/20 0.33
SCN4A P35499 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP19A1 P11511 1/20 0.31
PDPK1 O15530 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ATM Q13315 1/20 0.31
ALOX15 P16050 1/20 0.31
CYP11B1 P15538 1/20 0.31

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
SCHEMBL5797199 0.84 MAPT (0.43) NOTUMALDH1A1RAB9ANPC1CYP1A2
SCHEMBL4801302 0.82 LTA4H (0.45) ALDH1A1NISCHRAB9ANPC1SCN4A
SCHEMBL4909130 0.82
SCHEMBL4489657 0.80 CYP2A6 (0.56) ALDH1A1CYP1A2CYP3A4CYP2A6MEN1
SCHEMBL1515426 0.80 NISCH (0.38) ALDH1A1NISCHRAB9ANPC1MEN1
SCHEMBL2412002 0.80 NOTUM (0.39) NOTUMRAB9ANPC1CYP1A2CYP2A6
SCHEMBL4590846 0.80 MAPK14 (0.35) ALDH1A1RAB9ANPC1KMT2ACYP19A1
SCHEMBL17841789 0.78 RAB9A (0.57) ALDH1A1RAB9ANPC1MAPK1CYP1A2
SCHEMBL4806685 0.76 CYP11B1 (0.49) ALDH1A1NISCHRAB9ANPC1CYP1A2
SCHEMBL5066564 0.76 CLK4 (0.48) ALDH1A1NISCHRAB9ANPC1CYP1A2

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

Appears in 5006 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113039184-B Compound and organic light emitting device comprising the same 株式会社LG化学 2024-07-12 CN claimed
CN-118290414-A Benzoxazole organic compound containing benzonaphthofuran and application thereof 宁波卢米蓝新材料有限公司 2024-07-05 CN claimed
CN-118291125-A Organic material composition and application thereof 宁波卢米蓝新材料有限公司 2024-07-05 CN claimed
WO-2024119977-A1 ORGANIC COMPOUND AND ORGANIC LIGHT EMISSION DIODE DEVICE COMPRISING SAME 四川阿格瑞新材料有限公司 2024-06-13 WO claimed
CN-118119198-A Organic electroluminescent device 北京夏禾科技有限公司 2024-05-31 CN claimed
EP-4003956-B1 CYCLIC DIONES AS HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-05-15 EP claimed
US-11980188-B2 Spiro cyclohexanedione derivates as herbicides SYNGENTA PARTICIPATIONS AG (CH) 2024-05-14 US claimed
CN-118005617-A Organic electroluminescent material and device thereof 北京夏禾科技有限公司 2024-05-10 CN claimed
CN-117964609-A Organic electroluminescent material and device thereof 北京夏禾科技有限公司 2024-05-03 CN claimed
CN-117946085-A Phosphorescent host material, preparation method thereof and organic electroluminescent device 吉林奥来德光电材料股份有限公司 2024-04-30 CN claimed
EP-0444889-A1 Novel synthesis of carbapenem intermediates MERCK & CO. INC. (US) 1991-09-04 EP claimed
EP-0417057-A2 Heterocyclic thiol-based sulfenimide compounds and rubber compositions containing them MONSANTO COMPANY (US) 1991-03-13 EP claimed
EP-0161211-B1 N-HETEROCYCLOSULFONYL-N'-PYRIMIDINYL AND -TRIAZINYL UREAS CIBA-GEIGY AG (CH) 1990-08-01 EP claimed
US-4936903-A HERBICIDES; PLANT GROWTH REGULATORS; RICE CROPS CIBA-GEIGY CORP. (US) 1990-06-26 US claimed
US-4875923-A HERBICIDE CIBA-GEIGY CORPORATION (US) 1989-10-24 US claimed
US-4814001-A PLANT GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1989-03-21 US claimed
US-4786731-A AMIDATION THE DOW CHEMICAL COMPANY (US) 1988-11-22 US claimed
EP-0161211-A1 N-heterocyclosulfonyl-N'-pyrimidinyl and -triazinyl ureas CIBA-GEIGY AG (CH) 1985-11-13 EP claimed
EP-0022634-B1 ACYLATED INDOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS AND DRUGS COMPRISING THEM TEIJIN LIMITED (JP) 1983-04-06 EP claimed
US-4102887-A ANTIDEPRESSANTS, ANXIETY RELIEVING AKTIEBOLAGET ASTRA (SE) 1978-07-25 US claimed