SCHEMBL29936699

SCHEMBL29936699

c1ccc(-c2cc3cccc(-c4ccccc4)c3s2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 2/20 0.47
CYP1B1 Q16678 2/20 0.47
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
S1PR5 Q9H228 6/20 0.44
S1PR4 O95977 5/20 0.44
HSD17B1 P14061 2/20 0.42
APP P05067 2/20 0.42
HSD17B2 P37059 1/20 0.41
IKBKB O14920 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
CHRNA7 P36544 1/20 0.39
HTR3A P46098 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
PTP4A3 O75365 2/20 0.38

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
SCHEMBL29212886 1.00 CYP1A1 (0.47) CYP1A1CYP1B1ESR1ESR2S1PR5
SCHEMBL29809458 0.83 PDE10A (0.48) TNF
SCHEMBL19756684 0.81 S1PR5 (0.42) S1PR5S1PR4CHRNA7HTR3ATNF
SCHEMBL29809418 0.79 CYP11B1 (0.49) KDM4ECYP1A2
SCHEMBL29809254 0.79 ADORA2A (0.41) CYP1A1CYP1B1ESR1ESR2S1PR5
SCHEMBL8677862 0.78 CYP1A1 (0.46) CYP1A1CYP1B1ESR1ESR2HSD17B1
SCHEMBL2368350 0.78 CYP1A1 (0.57) CYP1A1CYP1B1ESR1ESR2HSD17B1
SCHEMBL15697559 0.77 BCL2L1 (0.54) S1PR5S1PR4NPC1RAB9AMAPT
SCHEMBL12278524 0.76 CYP1A1 (0.56) CYP1A1CYP1B1ESR1ESR2HSD17B1
SCHEMBL23555964 0.74 CYP1A1 (0.54) CYP1A1CYP1B1ESR1ESR2HSD17B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120129408-A Self-assembled monolayer perovskite solar cell and preparation method thereof 天合光能股份有限公司 2025-06-10 CN claimed
WO-2024088117-A1 MXENE-BASED CONDUCTIVE INK HAVING ADJUSTABLE WORK FUNCTION, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN THIN FILM TRANSISTORS 郑州大学 2024-05-02 WO claimed
CN-115537073-B MXene-based conductive ink with adjustable work function, preparation method thereof and application thereof in thin film transistor 郑州大学 2023-09-01 CN claimed
CN-115537073-A MXene-based conductive ink with adjustable work function, preparation method thereof and application thereof in thin film transistor 郑州大学 2022-12-30 CN claimed
CN-120129408-A Self-assembled monolayer perovskite solar cell and preparation method thereof 天合光能股份有限公司 2025-06-10 CN disclosed
CN-115210239-B Aromatic compound, organic semiconductor layer, and organic thin film transistor 东曹株式会社 2025-04-11 CN disclosed
CN-112992968-B Photoelectric conversion element, image pickup element, stacked image pickup element, and solid-state image pickup device 索尼公司 2024-11-15 CN disclosed
WO-2024088117-A1 MXENE-BASED CONDUCTIVE INK HAVING ADJUSTABLE WORK FUNCTION, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF IN THIN FILM TRANSISTORS 郑州大学 2024-05-02 WO disclosed
CN-115096965-B Thin film transistor type biochemical sensing microarray chip and preparation method thereof 上海交通大学 2023-09-08 CN disclosed
CN-115537073-B MXene-based conductive ink with adjustable work function, preparation method thereof and application thereof in thin film transistor 郑州大学 2023-09-01 CN disclosed
CN-115537073-A MXene-based conductive ink with adjustable work function, preparation method thereof and application thereof in thin film transistor 郑州大学 2022-12-30 CN disclosed
CN-115096965-A Thin film transistor type biochemical sensing microarray chip and preparation method thereof 上海交通大学 2022-09-23 CN disclosed