SCHEMBL26774

SCHEMBL26774

[CH2]Cc1ccccc1-c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP2C9 P11712 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP2D6 P10635 3/20 0.42
TDP1 Q9NUW8 2/20 0.41
ACP3 P15309 1/20 0.40
ADRA2A P08913 3/20 0.39
ADRA2B P18089 3/20 0.39
ADRA2C P18825 3/20 0.39
ADRA1A P35348 2/20 0.39
CYP2A6 P11509 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CTNNB1 P35222 1/20 0.39
ADRA1D P25100 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
SCHEMBL26212 0.82 CYP1A2 (0.58) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL477544 0.81 PDCD1 (0.47) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL27896460 0.79 DPP4 (0.53) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL2992860 0.79 MEN1 (0.49) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL31517086 0.79 CYP1A2 (0.45) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL4438778 0.79 CYP1A2 (0.45) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL3101185 0.79 CYP1A2 (0.45) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL11650416 0.79 CYP1A2 (0.45) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL9300875 0.79 CYP1A2 (0.45) CYP1A2CYP2C19CYP2C9ALDH1A1MAPT
SCHEMBL25302086 0.79 ALDH1A1 (0.59) CYP1A2ALDH1A1MAPTHPGDTDP1

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 4530 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112055711-B Cyclohexylic acid triazolazine as LPA antagonist 百时美施贵宝公司 2024-07-23 CN disclosed
WO-2024151257-A1 NUCLEOTIDE EXTENSION CHAIN VERIFICATION AGILENT TECHNOLOGIES, INC. (US) 2024-07-18 WO disclosed
US-20240240229-A1 METHODS OF ADMINISTERING MONOMETHYL FUMARATE AND PRODRUGS THEREOF HAVING REDUCED SIDE EFFECTS HPS INVESTMENT PARTNERS, LLC, AS ADMINISTRATIVE AGENT 2024-07-18 US disclosed
US-12037357-B2 Compounds for activating invariant natural killer T-cells and methods of use in eliminating inflammatory senescent cells DECIDUOUS THERAPEUTICS, INC. (US) 2024-07-16 US disclosed
CN-112689634-B SMAD3 inhibitors 莫扎制药有限公司 2024-07-16 CN disclosed
US-12037340-B2 Pentacyclic derivatives as Zika virus inhibitors GILEAD SCIENCES, INC. (US) 2024-07-16 US disclosed
CN-118355029-A Methods of treating diffuse large B-cell lymphomas using anti-CD 79B immunoconjugates 基因泰克公司 2024-07-16 CN disclosed
US-12037415-B2 Peptide and pharmaceutical composition for treating an eye disease comprising the same as an active pharmaceutical ingredient YUYU PHARMA, INC. (KR) 2024-07-16 US disclosed
US-20240229126-A1 NUCLEOTIDE EXTENSION CHAIN VERIFICATION AGILENT TECHNOLOGIES, INC. 2024-07-11 US disclosed
US-20240228444-A1 HETEROCYCLIC COMPOUNDS AND RELATED METHODS RECURSION PHARMACEUTICALS, INC. 2024-07-11 US disclosed
WO-2002005837-A1 ANTIMICROBIAL SULFONAMIDE DERIVATIVES OF LIPOPEPTIDE ANTIBIOTICS INTRABIOTICS PHARMACEUTICALS, INC. (US) 2002-01-24 WO disclosed
WO-2002005838-A1 DERIVATIVES OF LASPARTOMYCIN AND PREPARATION AND USE THEREOF INTRABIOTICS PHARMACEUTICALS, INC. (US) 2002-01-24 WO disclosed
WO-2001091758-A1 WATER-SOLUBLE AMIDE DERIVATIVES OF POLYENE MACROLIDES AND PREPARATION AND USES THEREOF INTRABIOTICS PHARMACEUTICALS, INC. (US) 2001-12-06 WO disclosed
EP-1141137-A1 WATER-SOLUBLE RHODAMINE DYES AND CONJUGATES THEREOF Applera Corporation (US) 2001-10-10 EP disclosed
WO-2001049790-A2 MOBILITY-MODIFYING CYANINE DYES APPLERA CORPORATION (US) 2001-07-12 WO disclosed
US-20010007905-A1 Extended rhodamine dye compound suitable for the creating of sets of spactrally resolvable fluorescent labels particlularly useful for fluorescence based DNA sequencing system THE PERKIN-ELMER CORPORATION 2001-07-12 US disclosed
US-6248884-B1 PARTICULARLY WELL SUITED FOR USE IN AUTOMATED FLUORESCENCE-BASED DNA SEQUENCING SYSTEMS USING AN EXCITATION LIGHT SOURCE HAVING A WAVELENGTH GREATER THAN ABOUT 630 NM, E.G., A HELIUM-NEON GAS LASER OR A SOLID STATE DIODE LASER. THE PERKIN-ELMER CORPORATION 2001-06-19 US disclosed
WO-2001032783-A1 WATER-SOLUBLE RHODAMINE DYES AND CONJUGATES THEREOF APPLERA CORPORATION (US) 2001-05-10 WO disclosed
US-6191278-B1 COMPRISING A RHODAMINE-TYPE PARENT RING HAVING ATTACHED TO THE XANTHENE C9 CARBON A PHENYL GROUP THAT IS SUBSTITUTED WITH CARBOXY OR SULFONATE GROUP, ONE TO THREE AMINOPYRIDINIUM GROUPS AND AN ALKYL- OR ARYLTHIO, AND OPTIONALLY OTHER GROUPS PE CORPORATION 2001-02-20 US disclosed
WO-2000075236-A1 EXTENDED RHODAMINE COMPOUNDS USEFUL AS FLUORESCENT LABELS PE CORPORATION (NY) (US) 2000-12-14 WO disclosed