SCHEMBL694020

SCHEMBL694020

N#Cc1ccc(Oc2cc(Cl)cc(Cl)c2)c(S(=O)(=O)N2CCN(C(=O)Nc3cccc(F)c3)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 1/20 0.46
USP2 O75604 5/20 0.45
CYP3A4 P08684 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 6/20 0.45
HIF1A Q16665 3/20 0.45
CYP2C9 P11712 2/20 0.45
PTPN11 Q06124 1/20 0.43
TSHR P16473 1/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C19 P33261 2/20 0.42
FAAH O00519 1/20 0.42
ENPP2 Q13822 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
MAPK1 P28482 2/20 0.41
HTT P42858 1/20 0.41
HPGD P15428 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL694379 0.90 SMN1; SMN2 (0.45) USP2CYP3A4SMN1; SMN2ALDH1A1HIF1A
SCHEMBL12693489 0.89 MAPK1 (0.45) USP2CYP3A4ALDH1A1HIF1ATSHR
SCHEMBL12317732 0.86 CACNA1H (0.44) CACNA1HUSP2CYP3A4SMN1; SMN2LMNA
SCHEMBL12253174 0.86 KMT2A (0.51) USP2SMN1; SMN2LMNAALDH1A1HTT
SCHEMBL693221 0.86 USP2 (0.50) USP2CYP3A4SMN1; SMN2ALDH1A1CYP2C9
SCHEMBL12693483 0.84 CACNA1H (0.46) CACNA1HUSP2CYP3A4SMN1; SMN2LMNA
SCHEMBL12253135 0.82 CACNA1H (0.42) CACNA1HUSP2CYP3A4SMN1; SMN2ALDH1A1
SCHEMBL12693492 0.81 ALDH1A1 (0.50) SMN1; SMN2LMNAALDH1A1HTT
SCHEMBL694272 0.81 MEN1 (0.52) CYP3A4SMN1; SMN2LMNACYP2C9TSHR
SCHEMBL3109989 0.81 TBXA2R (0.54) CYP3A4ALDH1A1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2502921-B1 Arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS INC (US) 2015-05-20 EP disclosed
US-8658642-B2 Arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2014-02-25 US disclosed
US-20130217687-A1 ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. (US) 2013-08-22 US disclosed
US-8420639-B2 Arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2013-04-16 US disclosed
EP-2502921-A1 Arylsulfonamide CCR3 antagonists Axikin Pharmaceuticals, Inc. (US) 2012-09-26 EP disclosed
EP-2421838-A2 ARYLSULFONAMIDE CCR3 ANTAGONISTS Axikin Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
US-20100273795-A1 ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. (US) 2010-10-28 US disclosed
WO-2010123960-A2 ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. (US) 2010-10-28 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-20100273795-A1 ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 CACNA1H 3704/4885USP2 1309/4885CYP3A4 3259/4885
US-20130217687-A1 ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 CACNA1H 3704/4885USP2 1309/4885CYP3A4 3259/4885

“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.