SCHEMBL3662718

SCHEMBL3662718

Cc1ccsc1-n1cccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
CYP2C19 P33261 5/20 0.44
CYP1A2 P05177 4/20 0.44
CYP3A4 P08684 4/20 0.44
CYP2D6 P10635 4/20 0.44
RECQL P46063 3/20 0.44
CYP2C9 P11712 3/20 0.44
HPGD P15428 3/20 0.44
KDM4E B2RXH2 3/20 0.44
HTT P42858 1/20 0.44
POLB P06746 6/20 0.36
MAPT P10636 5/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
RXFP1 Q9HBX9 1/20 0.35
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
ATM Q13315 1/20 0.34
MEN1 O00255 2/20 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
SCHEMBL6571813 0.70 NOTUM (0.39) ALDH1A1CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL12270234 0.70 KDM4E (0.35) ALDH1A1CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL8117726 0.68 GAA (0.35) ALDH1A1RECQLKDM4EMAPTMEN1
SCHEMBL9911010 0.68 MAPT (0.41) ALDH1A1CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL13811347 0.68 ALDH1A1 (0.42) ALDH1A1CYP2C19CYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL9619033 0.67 CYP2A6 (0.32) RECQLKDM4EMAPTMEN1KMT2A
SCHEMBL9672332 0.67 POLB (0.58) ALDH1A1RECQLHPGDKDM4EPOLB
SCHEMBL9024972 0.67 L3MBTL1 (0.42) ALDH1A1CYP1A2RECQLKDM4EPOLB
SCHEMBL14886148 0.67 MAPK8 (0.38) ALDH1A1CYP2C19CYP3A4CYP2D6RECQL
Bromide SCHEMBL7296632 0.65 L3MBTL1 (0.41) ALDH1A1CYP1A2RECQLKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10175557-B2 Optical wavelength conversion element containing ionic liquid, and article equipped with said optical wavelength conversion element NIPPON KAYAKU KABUSHIKIKAISHA (JP) 2019-01-08 US disclosed
US-20170084758-A1 Optical Wavelength Conversion Element Containing Ionic Liquid, And Article Equipped With Said Optical Wavelength Conversion Element NIPPON KAYAKU KABUSHIKIKAISHA (JP) 2017-03-23 US disclosed
EP-2500340-A1 2-Cyanophenyl Sulfonamide Derivatives Useful as Pesticides Syngenta Participations AG. (CH) 2012-09-19 EP disclosed
US-20100311582-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-12-09 US disclosed
EP-2231632-A2 2-CYANOPHENYL SULFONAMIDE DERIVATIVES USEFUL AS PESTICIDES Syngenta Participations AG (CH) 2010-09-29 EP disclosed
WO-2009092590-A2 CHEMICAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2009-07-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100311582-A1 CHEMICAL COMPOUNDS CBR3, CBR1, CCNY ALDH1A1 3581/4885CYP2C19 1159/4885CYP1A2 421/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.