SCHEMBL11537889

SCHEMBL11537889

CCCOc1cccc(C(c2ccccc2)(c2ccccc2)c2ccc(=O)[nH]c2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 3/20 0.41
SOD1 P00441 1/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 3/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
MAPK1 P28482 1/20 0.36
KAT6A Q92794 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
RAB9A P51151 1/20 0.36
NR1H4 Q96RI1 1/20 0.36

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
SCHEMBL11533246 0.79 KIF11 (0.40) KMT2AL3MBTL1MAPTSOD1MEN1
SCHEMBL11540051 0.77 ALDH1A1 (0.40) KMT2AL3MBTL1MAPTMEN1SMN1; SMN2
SCHEMBL11536704 0.74 RORC (0.41) LMNAALDH1A1
SCHEMBL11539449 0.74 KMT2A (0.41) KMT2AL3MBTL1MAPTMEN1SMN1; SMN2
SCHEMBL11536087 0.74 KMT2A (0.50) KMT2AL3MBTL1MAPTMEN1SMN1; SMN2
SCHEMBL11536812 0.73 ALDH1A1 (0.42) KMT2ASOD1MEN1SMN1; SMN2ALDH1A1
SCHEMBL11535177 0.73 KCNN4 (0.42) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL11535988 0.72 TSHR (0.38) KMT2AL3MBTL1MAPTMEN1SMN1; SMN2
SCHEMBL10211503 0.72 L3MBTL1 (0.57) KMT2AL3MBTL1MAPTSOD1SMN1; SMN2
SCHEMBL11537656 0.71 KMT2A (0.41) KMT2AL3MBTL1MAPTMEN1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4139625-A 5-(Substituted triphenylmethyl)picolinamides and their use as anti-acne agents SCHERING CORPORATION (US) 1979-02-13 US disclosed
US-4133887-A Trityl picolinic acid derivatives and their use as anti-acne agents SCHERING CORPORATION (US) 1979-01-09 US disclosed
US-4127662-A ANTIACNE SCHERING CORPORATION (US) 1978-11-28 US disclosed
US-4123433-A ANTIACNE AGENTS SCHERING CORPORATION (US) 1978-10-31 US disclosed
US-4044140-A Trityl picolinic acid derivatives and their use as anti-acne agents SCHERING CORPORATION (US) 1977-08-23 US disclosed