SCHEMBL8700100

SCHEMBL8700100

CS(=O)(=O)Oc1ccc(C(=O)O)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
CASP1 P29466 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.46
ALDH1A1 P00352 5/20 0.44
MYC P01106 1/20 0.44
NR4A1 P22736 1/20 0.44
PPARA Q07869 1/20 0.43
FLT1 P17948 2/20 0.42
FLT4 P35916 2/20 0.42
KDR P35968 2/20 0.42
ALPL P05186 1/20 0.40
ALPI P09923 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 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
SCHEMBL9325335 0.87 ALDH1A1 (0.47) SMN1; SMN2LMNAALDH1A1PPARAFLT1
SCHEMBL11779341 0.84 ALDH1A1 (0.58) SMN1; SMN2LMNAALDH1A1CA2CA5A
SCHEMBL295414 0.79 SMN1; SMN2 (0.57) TSHRCASP1SMN1; SMN2LMNAALDH1A1
Hydrochloric Acid SCHEMBL11848402 0.77 AKR1C3 (0.55) TSHRCASP1SMN1; SMN2LMNAFLT1
SCHEMBL6416634 0.77 ALDH1A1 (0.44) TSHRSMN1; SMN2ALDH1A1CA12CA1
SCHEMBL10477056 0.76 KDM4E (0.67) TSHRCASP1SMN1; SMN2LMNAALDH1A1
SCHEMBL3418753 0.76 ALDH1A1 (0.71) TSHRCASP1SMN1; SMN2ALDH1A1MYC
SCHEMBL1786859 0.75 ALDH1A1 (0.43) CASP1LMNAALDH1A1PPARAALPL
SCHEMBL7979793 0.75 ALPL (0.48) SMN1; SMN2ALDH1A1PPARAALPLALPI
SCHEMBL9740555 0.75 AKR1C3 (0.45) TSHRSMN1; SMN2ALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5801120-A HERBICIDES FOR CONTROLLING WEEDS SANDOZ LTD. (CH) 1998-09-01 US disclosed
US-5700762-A HERBICIDES SANDOZ LTD. (CH) 1997-12-23 US disclosed
US-5608101-A HERBICIDES NOVARTIS AG (CH) 1997-03-04 US disclosed
US-5089046-A Herbicides or miticide SANDOZ LTD. (CH) 1992-02-18 US disclosed
CN-1038093-A To organic compound with about the improvement of organic compound SANDOZ LTD (CH) 1989-12-20 CN disclosed
EP-0338992-A2 Substituted aryl and heteroaryl bicyclodiones SANDOZ AG (CH) 1989-10-25 EP disclosed
EP-0336898-A2 Substituted aryl or heteroaryl diones SANDOZ AG (CH) 1989-10-11 EP disclosed