SCHEMBL7417622

SCHEMBL7417622

[c]1sccc1-c1cccc2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
PTPN1 P18031 1/20 0.36
ALPL P05186 1/20 0.36
GAA P10253 1/20 0.36
ALDH1A1 P00352 5/20 0.36
TSHR P16473 4/20 0.36
HSD17B10 Q99714 4/20 0.36
CYP2A6 P11509 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
NISCH Q9Y2I1 1/20 0.35
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
HPGD P15428 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 1/20 0.34
KEAP1 Q14145 1/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL1819078 0.73 ALDH1A1 (0.43) KDM4EPTPN1ALPLGAAALDH1A1
SCHEMBL7045155 0.72 ALDH1A1 (0.37) ALDH1A1HSD17B10CYP2A6TDP1NISCH
SCHEMBL29350007 0.71 ALDH1A1 (0.59) KDM4EPTPN1ALPLGAAALDH1A1
SCHEMBL27953 0.71 ALDH1A1 (0.59) KDM4EPTPN1ALPLGAAALDH1A1
SCHEMBL25302086 0.71 ALDH1A1 (0.59) KDM4EPTPN1ALPLGAAALDH1A1
SCHEMBL5943539 0.70 CYP2A6 (0.39) ALDH1A1CYP2A6HPGDMAPT
SCHEMBL10958042 0.69 ALDH1A1 (0.45) KDM4EPTPN1ALPLGAAALDH1A1
Bromide SCHEMBL8588309 0.69 ALDH1A1 (0.56) KDM4EPTPN1ALPLGAAALDH1A1
Ammonia Solution, Strong SCHEMBL3156160 0.69 ALDH1A1 (0.56) KDM4EPTPN1ALPLGAAALDH1A1
Bromide SCHEMBL7106161 0.69 ALDH1A1 (0.56) KDM4EPTPN1ALPLGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0932598-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1$g(b) CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1999-08-04 EP claimed
CN-1222510-A Arylacetic amide derivative or salt thereof, and pharmaceutical comprising it SSP CO LTD (JP) 1999-07-14 CN claimed
WO-1998016502-A1 ASPARTATE ESTER INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME WARNER-LAMBERT COMPANY (US) 1998-04-23 WO claimed
EP-0069377-B1 ANTIBACTERIAL PENEM DERIVATIVES HOECHST UK LIMITED (GB) 1988-06-22 EP claimed
JP-6211804-A None JP disclosed
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 CN disclosed
CN-106573912-A Triazine compound, method for producing same, and application for same 东曹株式会社 2017-04-19 CN disclosed
WO-2017019770-A1 COMPOSITIONS AND METHODS RELATING TO GALECTIN DETECTION WAYNE STATE UNIVERSITY (US) 2017-02-02 WO disclosed
CN-1926081-B Metal complexes for use in olefin methathesis and atom or group transfer reactions UNIV GENT 2011-06-15 CN disclosed
CN-1926081-A Metal complexes for use in olefin methathesis and atom or group transfer reactions UNIV GENT (BE) 2007-03-07 CN disclosed
CN-1185217-C Propanolamine derivatives, processes for their preparation, pharmaceuticals comprising these compounds, and their use AVENTIS PHARMA GMBH (DE) 2005-01-19 CN disclosed
WO-2001019373-A2 METHODS AND COMPOSITIONS FOR MODULATING RESPONSIVENESS TO CORTICOSTEROIDS BASF AKTIENGESELLSCHAFT (DE) 2001-03-22 WO disclosed
EP-0998300-A1 METHODS AND COMPOSITIONS FOR MODULATING RESPONSIVENESS TO CORTICOSTEROIDS BASF AKTIENGESELLSCHAFT (DE) 2000-05-10 EP disclosed
WO-1998041232-A2 COMPOSITIONS FOR MODULATING RESPONSIVENESS TO CORTICOSTEROIDS BASF AKTIENGESELLSCHAFT (DE) 1998-09-24 WO disclosed
JP-H06211804-A FUNGICIDAL 2-ALKOXY-2-IMIDAZOLIN-5-ONE DERIVATIVE RHONE POULENC AGROCHIM 1994-08-02 JP disclosed
US-4269936-A A COUPLER BASED ON AN ACYLACETAMIDE HAVING BONDED ONTO THE ALPHA CARBON A NITROGEN ATOM ACTIVATED BY TWO CARBONYL GROUPS; SILVER HALIIDE EMULSIONS; AMINE DEVELOPERS; SHARPNESS FUJI PHOTO FILM CO., LTD. (JP) 1981-05-26 US disclosed
US-4106942-A COMPOUNDS CONTAINING SULFIDE, KETONE, AND AMIDE GROUPS FUJI PHOTO FILM CO., LTD. (JP) 1978-08-15 US disclosed
US-4022620-A SILVER HALIDE, AMINE FUJI PHOTO FILM CO., LTD. (JA) 1977-05-10 US disclosed
US-4012259-A DICARBONYL METHYLENE GROUP ON A 2,5-DIOXO-1-IMIDAZOLIDINE IS A YELLOW COUPLER FUJI PHOTO FILM CO., LTD. (JA) 1977-03-15 US disclosed
US-3990896-A YELLOW COLOR FORMING COUPLERS WITH 5-ALKYLIDINE-3-HYDANTOINYL GROUPS FUJI PHOTO FILM CO., LTD. (JA) 1976-11-09 US disclosed