SCHEMBL9367374

SCHEMBL9367374

ClC(Cl)(Cl)Oc1ccccc1OC(Cl)(Cl)Cl

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA12 O43570 1/20 0.38
CA4 P22748 1/20 0.38
CA14 Q9ULX7 1/20 0.38
TSHR P16473 3/20 0.36
TP53 P04637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ADRA2B P18089 1/20 0.31
PTGS1 P23219 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL8991056 0.87 CA1 (0.62) CA1CA2CA7CA9CA12
SCHEMBL10917461 0.84 TSHR (0.36) CA1CA2CA7CA9CA12
SCHEMBL28003345 0.84 LMNA (0.43) TSHRALDH1A1TDP1LMNASMN1; SMN2
SCHEMBL914798 0.84 LMNA (0.43) TSHRALDH1A1TDP1LMNASMN1; SMN2
SCHEMBL9215888 0.83 KDM4E (0.35) LMNA
SCHEMBL10913428 0.83 DRD1 (0.40) TDP1LMNA
SCHEMBL7192709 0.82 TSHR (0.43) CA1CA2CA7CA9CA12
SCHEMBL6298496 0.82 CA2 (0.50) CA1CA2CA12CA4CA14
SCHEMBL7938418 0.82 L3MBTL1 (0.38) ALDH1A1TDP1
SCHEMBL10910618 0.82 DRD1 (0.39) ALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365915-B1 Substituted 2-aminothiazoles BAYER AG (DE) 1994-04-20 EP disclosed
US-4956370-A FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1990-09-11 US disclosed
EP-0368008-A1 Fluorine-containing phenols BAYER AG (DE) 1990-05-16 EP disclosed
EP-0365915-A2 Substituted 2-aminothiazoles BAYER AG (DE) 1990-05-02 EP disclosed