SCHEMBL131392

SCHEMBL131392

Brc1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.55
HPGD P15428 5/20 0.55
CYP1A2 P05177 5/20 0.55
HSD17B10 Q99714 4/20 0.55
CYP3A4 P08684 3/20 0.55
TSHR P16473 3/20 0.55
CYP1A1 P04798 2/20 0.55
CYP1B1 Q16678 2/20 0.55
TDP1 Q9NUW8 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ERBB2 P04626 1/20 0.50
FYN P06241 1/20 0.50
MAOA P21397 1/20 0.50
ACHE P22303 1/20 0.50
AHR P35869 1/20 0.50
THRB P10828 1/20 0.50
KDM4E B2RXH2 5/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 3/20 0.39
GLA P06280 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
SCHEMBL29406157 1.00 ALDH1A1 (0.55) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
SCHEMBL30792507 1.00 ALDH1A1 (0.55) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
Formaldehyde SCHEMBL11870785 0.93 ALDH1A1 (0.48) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
Boric Acid SCHEMBL28468951 0.91 ALDH1A1 (0.47) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
SCHEMBL29789405 0.89 CYP1A2 (0.39) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
Butane SCHEMBL27736537 0.89 ALDH1A1 (0.50) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
SCHEMBL2835557 0.89 CYP1A2 (0.39) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
SCHEMBL1062422 0.89 CYP1A2 (0.39) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
SCHEMBL283079 0.89 CYP1A2 (0.39) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4
SCHEMBL31006766 0.87 HSD17B10 (0.67) ALDH1A1HPGDCYP1A2HSD17B10CYP3A4

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 1349 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120000578-A Nanometer semen Ziziphi Spinosae saponin and its preparation method 洛阳师范学院 2025-05-16 CN claimed
CN-115894251-B Diamine monomer containing pyrene and triphenylamine structures, preparation method of diamine monomer, polyimide, preparation method of polyimide and application of polyimide 中山大学 2025-04-11 CN claimed
CN-119241426-A Pyrenyl Schiff base fluorescent derivative, fluorescent probe, preparation method of pyrenyl Schiff base fluorescent derivative and application of pyrenyl Schiff base fluorescent derivative and fluorescent probe in biological imaging 河北师范大学 2025-01-03 CN claimed
CN-116332841-B For dual excitation wavelength continuity detection of Al3+And F-Fluorescent probe of (2), preparation method and application thereof 浙江工业大学 2025-01-03 CN claimed
CN-119064498-A Synchronous rapid detection method for 31 halogenated polycyclic aromatic hydrocarbons in complex cooked food matrix 广东工业大学 2024-12-03 CN claimed
CN-118180139-B Method for degrading halogenated polycyclic aromatic hydrocarbon in soil by using manganese potassium ore 南京农业大学 2024-09-06 CN claimed
CN-118180139-A Method for degrading halogenated polycyclic aromatic hydrocarbon in soil by using manganese potassium ore 南京农业大学 2024-06-14 CN claimed
CN-118108685-A Fluorescent probe for targeting lipid droplets, and synthesis method and biological application thereof 中国科学院大连化学物理研究所 2024-05-31 CN claimed
CN-118109186-A Environment-sensitive lipid-droplet fluorescent dye and synthetic method and application thereof 中国科学院大连化学物理研究所 2024-05-31 CN claimed
CN-118108649-A Thermochromic lipid drop probe and synthesis and application thereof 中国科学院大连化学物理研究所 2024-05-31 CN claimed
CN-101225298-A Hole-transporting type blue luminescent material as well as preparation and uses thereof CHINESE ACAD INST CHEMISTRY (CN) 2008-07-23 CN claimed
US-7074885-B2 Electroactive fluorene copolymers and devices made with such polymers E.I. DU PONT DE NEMOURS AND COMPANY (US) 2006-07-11 US claimed
US-6797745-B1 Hot melt inks containing styrene or terpene polymers XEROX CORPORATION 2004-09-28 US claimed
US-4282298-A OVERCOATING THE PHOTOCONDUCTIVE LAYER WITH A CHARGE TRANSFER COMPOUND OF AROMATIC POLYNUCLEAR STRUCTURE; XEROGRAPHY XEROX CORPORATION (US) 1981-08-04 US claimed
US-4252882-A Developing electrophotographic images using aqueous ink and treating smooth, hydrophobic image surface with cleaning liquid HOECHST AKTIENGESELLSCHAFT (DE) 1981-02-24 US claimed
US-4224395-A FLEXIBILITY HOECHST AKTIENGESELLSCHAFT (DE) 1980-09-23 US claimed
US-4220697-A NOT PRONE TO FORMATION OF HAIRLINE CRACKS WHEN REPEATEDLY CONDUCTED OVER ROLLERS HOECHST AKTIENGESELLSCHAFT (DE) 1980-09-02 US claimed
US-3982937-A 3-BROMOPYRENE-FORMALDEHYDE CONDENSATION PRODUCT, SELENIUM OR SELENIUM-TELLURIUM HOECHST AKTIENGESELLSCHAFT (DT) 1976-09-28 US claimed
US-3972717-A DYE, PHOTOCONDUCTOR HOECHST AKTIENGESELLSCHAFT (DT) 1976-08-03 US claimed
US-3955978-A Electrophotographic recording material HOECHST AKTIENGESELLSCHAFT (DT) 1976-05-11 US claimed