SCHEMBL9075467

SCHEMBL9075467

Cc1ccc(C2CCC(c3ccc(Oc4ccc(N)cc4)c(C(F)(F)F)c3)(c3ccc(Oc4ccc(N)cc4)c(C(F)(F)F)c3)CC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TEAD4 Q15561 1/20 0.37
ALDH1A1 P00352 3/20 0.36
MAPT P10636 3/20 0.36
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SLC6A4 P31645 3/20 0.35
HTR2A P28223 1/20 0.35
KCNH2 Q12809 1/20 0.35
SYK P43405 1/20 0.34
AR P10275 6/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A2 P23975 2/20 0.32
SLC6A3 Q01959 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
RAB9A P51151 1/20 0.32
FFAR1 O14842 2/20 0.31
LMNA P02545 1/20 0.30
ATM Q13315 1/20 0.30
MAPK1 P28482 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
SCHEMBL9075446 0.94 SLC6A4 (0.35) TEAD4ALDH1A1MAPTPOLBTDP1
SCHEMBL9075012 0.89 NCOA1 (0.36) ALDH1A1SLC6A4ARSLC6A2SLC6A3
SCHEMBL9075551 0.89 L3MBTL1 (0.33) MAPTSLC6A4ARSLC6A2SLC6A3
SCHEMBL9075457 0.87 AR (0.32) ALDH1A1MAPTSLC6A4ARSLC6A2
SCHEMBL9073459 0.86 TEAD4 (0.39) TEAD4ALDH1A1MAPTPOLBTDP1
SCHEMBL9076164 0.86 TEAD4 (0.41) TEAD4ALDH1A1MAPTPOLBTDP1
SCHEMBL9073265 0.86 SPHK1 (0.36)
SCHEMBL9075043 0.85 SPHK1 (0.40)
SCHEMBL9074823 0.84 SPHK1 (0.42)
SCHEMBL9074539 0.84 SPHK1 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545444-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1996-08-13 US disclosed
US-5430195-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1995-07-04 US disclosed
US-5414126-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1995-05-09 US disclosed