SCHEMBL4282865

SCHEMBL4282865

CCSc1nnnn1-c1ccc(C#N)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
TP53 P04637 1/20 0.49
POLB P06746 5/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 2/20 0.45
USP2 O75604 2/20 0.42
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
LMNA P02545 2/20 0.42
TSHR P16473 2/20 0.42
PKM P14618 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 4/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
KDM4E B2RXH2 2/20 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
SCHEMBL13328373 0.76 TRPV4 (0.47)
SCHEMBL10448699 0.71 ALDH1A1 (0.71) ALDH1A1TP53POLBSMN1; SMN2KMT2A
SCHEMBL10448232 0.70 ALDH1A1 (1.00) ALDH1A1TP53POLBSMN1; SMN2MAPK1
SCHEMBL10519776 0.69 ALDH1A1 (0.51) ALDH1A1TP53POLBSMN1; SMN2MAPK1
SCHEMBL24019594 0.67 TP53 (0.72) ALDH1A1TP53POLBMAPK1KMT2A
SCHEMBL7934631 0.66 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL7934367 0.66 ALDH1A1 (0.54) ALDH1A1TP53POLBSMN1; SMN2MAPK1
SCHEMBL21641941 0.66 CYP11B1 (0.40)
SCHEMBL8827928 0.66 TP53 (1.00) ALDH1A1TP53POLBKMT2AMEN1
SCHEMBL2530213 0.65 EGLN2 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1923385-B1 Iridium complex, carbazole derivatives and copolymer having the same KWANGJU INST SCI & TECH (KR) 2009-05-27 EP claimed
EP-1923385-A1 Iridium complex, carbazole derivatives and copolymer having the same Gwangju Institute of Science and Technology (KR) 2008-05-21 EP claimed
EP-1923385-B1 Iridium complex, carbazole derivatives and copolymer having the same KWANGJU INST SCI & TECH (KR) 2009-05-27 EP disclosed
EP-1923385-A1 Iridium complex, carbazole derivatives and copolymer having the same Gwangju Institute of Science and Technology (KR) 2008-05-21 EP disclosed