SCHEMBL11535358

SCHEMBL11535358

CCc1cccc(C(c2ccccc2)(c2ccccc2)c2ccc(C(=O)O)nc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 8/20 0.45
KDM4E B2RXH2 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
THPO P40225 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
KMT2A Q03164 1/20 0.43
HIF1A Q16665 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
BCL2 P10415 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
Picotrin SCHEMBL2109455 0.84 P4HTM (0.50) P4HTMKDM4EL3MBTL1ALDH1A1LMNA
SCHEMBL11534846 0.83 ALDH1A1 (0.39) KDM4EALDH1A1LMNAMAPTMRGPRX4
SCHEMBL11536087 0.82 KMT2A (0.50) P4HTMKDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL11536461 0.81 KDM4E (0.49) P4HTMKDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL11535031 0.81 KCNN4 (0.46) P4HTMKDM4EALDH1A1MAPK1P4HA1
SCHEMBL11540602 0.80 P4HTM (0.51) P4HTMKDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL11535667 0.80 KIF11 (0.40) MEN1KMT2AKIF11SMN1; SMN2
SCHEMBL11538682 0.79 P4HTM (0.45) P4HTMKDM4EL3MBTL1ALDH1A1LMNA
SCHEMBL11534919 0.78 KMO (0.47) P4HTMKDM4EALDH1A1KMT2AMAPK1
SCHEMBL11533308 0.78 KMO (0.53) KDM4EMEN1ALDH1A1LMNACYP1A2

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