SCHEMBL24282901

SCHEMBL24282901

N#Cc1cccc(-c2ccc3c4ccc(-c5cccc(C#N)c5)cc4n(-c4cccc5c4C(=O)N(c4cccc(-c6ccccc6)c4)C5O)c3c2)c1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 1/20 0.36
▸ PTGES O14684 1/20 0.35
▸ PTPN5 P54829 1/20 0.35
▸ MCHR1 Q99705 2/20 0.35
▸ XDH P47989 1/20 0.34
▸ SLC22A12 Q96S37 1/20 0.34
▸ PGR P06401 2/20 0.34
▸ GRIA2 P42262 1/20 0.34
▸ GRIA4 P48058 1/20 0.34
▸ USP30 Q70CQ3 1/20 0.33
▸ MMP12 P39900 1/20 0.32
▸ MMP13 P45452 1/20 0.32
▸ PRF1 P14222 1/20 0.32
▸ CHEK1 O14757 1/20 0.32
▸ CSF1R P07333 1/20 0.32
▸ ALDH1A3 P47895 1/20 0.32

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
SCHEMBL19843398 0.95 ATM (0.35) FFAR2PTGESPGRCHEK1
SCHEMBL19850281 0.94 G6PD (0.34) FFAR2PTGES
SCHEMBL24283023 0.93 FFAR2 (0.35) FFAR2PTGESPTPN5MCHR1XDH
SCHEMBL19850174 0.93 FFAR2 (0.36) FFAR2PTGESPTPN5MCHR1XDH
SCHEMBL19850175 0.92 FFAR2 (0.35) FFAR2PTGESPTPN5MCHR1XDH
SCHEMBL19850280 0.92 G6PD (0.33) PTGES
SCHEMBL19850087 0.91 COMT (0.35) —
SCHEMBL19842977 0.91 PGR (0.36) FFAR2PTGESPTPN5XDHSLC22A12
SCHEMBL19842383 0.90 TDP2 (0.35) PTGES
SCHEMBL19843237 0.89 PGR (0.36) FFAR2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3494112-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-20 — — EP disclosed
Send feedback