SCHEMBL1465760

SCHEMBL1465760

O=S(=O)(c1ccc(Cl)cc1)c1cscc1CO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPK1 P28482 1/20 0.47
POLB P06746 1/20 0.44
PSEN1 P49768 5/20 0.43
PSEN2 P49810 5/20 0.43
APH1B Q8WW43 5/20 0.43
NCSTN Q92542 5/20 0.43
APH1A Q96BI3 5/20 0.43
PSENEN Q9NZ42 5/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2D6 P10635 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
FEN1 P39748 1/20 0.37
CA1 P00915 2/20 0.37

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
SCHEMBL5259824 0.75 MEN1 (0.53) ALDH1A1MAPTCYP3A4MAPK1POLB
SCHEMBL1467521 0.72 ALDH1A1 (0.48) ALDH1A1MAPTCYP3A4MAPK1POLB
SCHEMBL4991868 0.71 ACHE (0.44) ALDH1A1MAPTCYP3A4MAPK1POLB
SCHEMBL4068852 0.70 CYP2D6 (0.43) ALDH1A1MAPTCYP2D6CA1CA2
SCHEMBL1467603 0.70 MAPT (0.52) ALDH1A1MAPTCYP3A4MAPK1POLB
SCHEMBL4328031 0.67 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPK1POLBMEN1
SCHEMBL9313173 0.67 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPK1POLBMEN1
SCHEMBL2122579 0.67 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPK1POLBMEN1
SCHEMBL22742 0.67 ALDH1A1 (1.00) ALDH1A1CYP3A4MAPK1POLBMEN1
SCHEMBL10869745 0.67 ALDH1A1 (0.68) ALDH1A1CYP3A4MAPK1POLBMEN1

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-20130225617-A1 INDOLES AND THEIR THERAPEUTIC USE PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2013-08-29 US disclosed
US-8394836-B2 Indoles and their therapeutic use PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2013-03-12 US disclosed
EP-2327693-A1 Indoles and their therapeutic use Pulmagen Therapeutics (Asthma) Limited (GB) 2011-06-01 EP disclosed
US-20110071175-A1 Indoles and Their Therapeutic Use GB005, INC. 2011-03-24 US disclosed
EP-2229358-A1 INDOLES AND THEIR THERAPEUTIC USE Pulmagen Therapeutics (Asthma) Limited (GB) 2010-09-22 EP disclosed
WO-2009077728-A1 INDOLES AND THEIR THERAPEUTIC USE ARGENTA DISCOVERY LIMITED (GB) 2009-06-25 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 (2 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-20130225617-A1 INDOLES AND THEIR THERAPEUTIC USE IDO2, IDO1, RORB ALDH1A1 1047/4885MAPT 3223/4885CYP3A4 2537/4885
US-20110071175-A1 Indoles and Their Therapeutic Use FPR3, HRH2, HRH4 ALDH1A1 1510/4885MAPT 4666/4885CYP3A4 1973/4885

“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.