SCHEMBL9114976

SCHEMBL9114976

Cc1ccccc1-n1[nH]c(C(=O)O)cc1=O

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 11/20 0.60
CTSA P10619 6/20 0.49
CYP3A4 P08684 1/20 0.49
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NOTUM Q6P988 1/20 0.44

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
SCHEMBL10607813 0.86 ALDH1A1 (0.46) ALKBH5CTSACYP3A4KDM4EALDH1A1
SCHEMBL9548226 0.83 ALKBH5 (0.54) ALKBH5CTSACYP3A4KDM4EALDH1A1
SCHEMBL10953568 0.83 ALKBH5 (0.62) ALKBH5CTSAKDM4EALDH1A1
SCHEMBL10938391 0.83 ALKBH5 (0.53) ALKBH5CTSAALDH1A1
SCHEMBL5522718 0.81 KDM4E (0.71) CTSACYP3A4KDM4EALDH1A1MAPT
SCHEMBL10949271 0.81 KDM4E (0.60) ALKBH5CTSAKDM4EALDH1A1MAPT
SCHEMBL9558930 0.81 ALKBH5 (0.51) ALKBH5CTSACYP3A4
SCHEMBL10940578 0.81 ALKBH5 (0.59) ALKBH5CTSAKDM4EALDH1A1
SCHEMBL7890888 0.81 ALKBH5 (0.59) ALKBH5CTSAKDM4EALDH1A1MAPT
SCHEMBL951472 0.78 ALKBH5 (0.73) ALKBH5CTSAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5424164-A Image forming method FUJI PHOTO FILM CO., LTD (JP) 1995-06-13 US disclosed
US-4544738-A FIBER-REACTIVE YELLOW AND ORANGE DYES BASF AKTIENGESELLSCHAFT (DE) 1985-10-01 US disclosed
US-4348318-A DYEING AND PRINTING TEXTILES; MONOAZO, TRIAZINE, HYDRAZONE, AND PYRAZOLONE DYES CIBA-GEIGY CORPORATION (US) 1982-09-07 US disclosed
EP-0017768-B1 REACTIVE DYESTUFFS AND THEIR USE BASF Aktiengesellschaft (DE) 1981-11-25 EP disclosed
EP-0017768-A1 Reactive dyestuffs and their use BASF Aktiengesellschaft (DE) 1980-10-29 EP disclosed