SCHEMBL6563880

SCHEMBL6563880

CCOC(=O)CSc1nc(Cl)cc(N2CCN(c3ccc(Cl)cc3)CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.51
TSHR P16473 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALOX5 P09917 2/20 0.46
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
PTGS2 P35354 1/20 0.44
MAPT P10636 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 2/20 0.43
RXFP1 Q9HBX9 2/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL6827151 0.78 KDM4E (0.58) TSHRTDP1ALOX5MAPTKMT2A
SCHEMBL6561975 0.74 ALOX5 (0.70) ALOX5CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL6562061 0.72 L3MBTL1 (0.61) TSHRTDP1ALOX5MAPTKMT2A
SCHEMBL6565677 0.72 ALOX5 (0.45) TDP1ALOX5CYP1A2CYP3A4CYP2C9
SCHEMBL6565474 0.71 ALOX5 (0.53) ALOX5CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL20271984 0.71 SMN1; SMN2 (0.69) USP2TSHRMAPTKMT2AMEN1
SCHEMBL6563451 0.70 ALOX5 (0.52) ALOX5CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL6563445 0.70 ALOX5 (0.52) ALOX5CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL6565776 0.70 L3MBTL1 (0.70) TDP1ALOX5CYP1A2CYP2C9CYP2C19
SCHEMBL11840409 0.69 ALOX5 (0.59) TSHRALOX5CYP3A4MAPTKMT2A

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
EP-1399426-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING BETA-AMYLOID PRODUCTION Active Pass Pharmaceuticals, Inc. (CA) 2004-03-24 EP disclosed
US-20030191144-A1 Compounds, compositions and methods for modulating beta-amyloid production ACTIVE PASS PHARMACEUTICALS, INC. (CA) 2003-10-09 US disclosed
US-20030125338-A1 Compounds, compositions and methods for modulating beta-amyloid production ACTIVE PASS PHARMACEUTICALS, INC. (CA) 2003-07-03 US disclosed
WO-2002100836-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING BETA-AMYLOID PRODUCTION ACTIVE PASS PHARMACEUTICALS, INC. (CA) 2002-12-19 WO disclosed
US-3940394-A ANTILIPEMIC SANTILLI ARTHUR A 1976-02-24 US 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-20030125338-A1 Compounds, compositions and methods for modulating beta-amyloid production APP, PPARA, PPARG USP2 3289/4885TSHR 3453/4885TDP1 1731/4885
US-20030191144-A1 Compounds, compositions and methods for modulating beta-amyloid production APP, PPARA, PPARG USP2 3289/4885TSHR 3453/4885TDP1 1731/4885

“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.