SCHEMBL2071745

SCHEMBL2071745

N#Cc1cc(Cl)cc(C(=O)CO)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.40
VNN1 O95497 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
ADRA1D P25100 1/20 0.37
GPR35 Q9HC97 2/20 0.37
TPMT P51580 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
NLRP3 Q96P20 1/20 0.34
RAB9A P51151 1/20 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
SCHEMBL19707524 0.84 GSK3B (0.58) GSK3BVNN1MRGPRX4ADRA1DGPR35
SCHEMBL9821033 0.84 GSK3B (0.39) GSK3BVNN1MRGPRX4ADRA1DGPR35
SCHEMBL1448228 0.80 TPMT (0.54) GSK3BTPMTTSHRRAB9A
SCHEMBL5223887 0.79 VNN1 (0.40) GSK3BVNN1MRGPRX4ADRA1DGPR35
SCHEMBL2565282 0.79 TPMT (0.61) VNN1MRGPRX4GPR35TPMTTSHR
SCHEMBL11069556 0.79 GSK3B (0.40) GSK3BVNN1GPR35ALDH1A1MAPT
SCHEMBL24156534 0.78 PARP1 (0.46) VNN1MRGPRX4ADRA1DGPR35TPMT
SCHEMBL16953692 0.78 MAPT (0.45) VNN1MRGPRX4ADRA1DGPR35TPMT
SCHEMBL19707525 0.76 MAPT (0.47) VNN1MRGPRX4ALDH1A1LMNAMAPT
SCHEMBL3488915 0.74 ALDH1A1 (0.46) VNN1MRGPRX4GPR35ALDH1A1L3MBTL1

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
US-7910742-B2 Survivin inhibitors ABBOTT LABORATORIES (US) 2011-03-22 US disclosed
US-20070072833-A1 Survivin inhibitors ABBVIE INC. 2007-03-29 US disclosed
EP-0834510-B1 Flavone derivative and medicine comprising the same KOWA CO (JP) 2005-02-23 EP disclosed
EP-0902007-B1 CHALCONE DERIVATIVES AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2003-11-05 EP disclosed
US-6136848-A ANTIALLERGENS; ASTHMA THERAPY KOWA CO., LTD. (JP) 2000-10-24 US disclosed
US-6046212-A ANTIALLERGIC AGENTS KOWA CO., LTD. (JP) 2000-04-04 US disclosed
EP-0902007-A1 CHALCONE DERIVATIVES AND DRUGS CONTAINING THE SAME KOWA CO. LTD. (JP) 1999-03-17 EP disclosed
EP-0834510-A2 Flavone derivative and medicine comprising the same KOWA CO. LTD. (JP) 1998-04-08 EP 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-20070072833-A1 Survivin inhibitors XIAP, BIRC5, BIRC3 GSK3B 520/4885VNN1 3719/4885MRGPRX4 3575/4885

“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.