SCHEMBL8633146

SCHEMBL8633146

Nc1nn[c]n1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.35
HPGD P15428 2/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPT P10636 4/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 2/20 0.35
STAT1 P42224 1/20 0.35
SIGMAR1 Q99720 3/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
LMNA P02545 2/20 0.33
BLM P54132 1/20 0.33
CASP9 P55211 1/20 0.33
CASP6 P55212 1/20 0.33
CASP8 Q14790 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL795390 0.75 AVPR1A (0.39) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL8629698 0.75 GAA (0.34) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL8631734 0.73 KMT2A (0.42) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL796343 0.71 ALDH1A1 (0.35) KDM4EHPGDPOLBMEN1KMT2A
SCHEMBL8625716 0.68 HCAR1 (0.38) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL8628934 0.68 HSD17B10 (0.44) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL17186577 0.62 KDM4E (0.39) KDM4EHPGDPOLBMEN1KMT2A
SCHEMBL633199 0.61 NOTUM (0.39) KDM4EHPGDPOLBMEN1KMT2A
SCHEMBL544340 0.60 MAPK1 (0.41) KDM4EHPGDPOLBMEN1KMT2A
Fenamole SCHEMBL43680 0.60 ALDH1A1 (0.53) HPGDPOLBMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35754-E FOR TREATING BACTERIAL INFECTIONS HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-24 US disclosed
US-5710146-A ANTIBIOTICS FOR BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1998-01-20 US disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
US-4399131-A Cephem derivatives HOECHST AG (DE) 1983-08-16 US disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed