SCHEMBL11536458

SCHEMBL11536458

O=C(O)c1ccc(C(c2ccccc2)(c2ccc(F)cc2)c2ccc(F)cc2)cn1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 10/20 0.52
KCNN4 O15554 2/20 0.46
P4HA1 P13674 1/20 0.43
MIF P14174 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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 0.92 P4HTM (0.50) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL11535031 0.88 KCNN4 (0.46) P4HTMKCNN4P4HA1MIFKDM4E
SCHEMBL11538682 0.86 P4HTM (0.45) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL11534919 0.85 KMO (0.47) P4HTMKCNN4P4HA1MIFKDM4E
SCHEMBL11540602 0.84 P4HTM (0.51) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL11534152 0.84 P4HTM (0.51) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL11538628 0.84 P4HTM (0.46) P4HTMKCNN4P4HA1MIFKDM4E
SCHEMBL11532398 0.82 KMO (0.48) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL11538266 0.81 P4HTM (0.51) P4HTMKDM4EALDH1A1L3MBTL1
SCHEMBL11536461 0.80 KDM4E (0.49) P4HTMP4HA1MIFKDM4EALDH1A1

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