SCHEMBL8629665

SCHEMBL8629665

Nn1[c]nnc1-c1ccccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 2/20 0.39
SMARCA2 P51531 2/20 0.39
SMARCA4 P51532 2/20 0.39
PBRM1 Q86U86 2/20 0.39
BRD4 O60885 1/20 0.39
KDM4A O75164 1/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
HSD17B10 Q99714 3/20 0.37
ALDH1A1 P00352 5/20 0.37
LMNA P02545 5/20 0.36
HPGD P15428 3/20 0.36
BCL2L1 Q07817 1/20 0.36
IDO1 P14902 3/20 0.36
MAPT P10636 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPK10 P53779 1/20 0.36

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
SCHEMBL16675470 0.69 LMNA (0.47) NR1I2SMARCA2SMARCA4PBRM1BRD4
SCHEMBL8627702 0.68 ALDH1A1 (0.46) NR1I2SMARCA2SMARCA4PBRM1BRD4
SCHEMBL28937585 0.66 ALDH1A1 (0.63) SMN1; SMN2HSD17B10ALDH1A1LMNAHPGD
SCHEMBL7845497 0.66 ALDH1A1 (0.63) SMN1; SMN2HSD17B10ALDH1A1LMNAHPGD
SCHEMBL27399790 0.64 ALDH1A1 (0.44) KDM4ASMN1; SMN2HSD17B10ALDH1A1LMNA
SCHEMBL8630057 0.64 BCHE (0.41) SMN1; SMN2HSD17B10ALDH1A1LMNAHPGD
Hydroxyamine SCHEMBL28237907 0.63 ALDH1A1 (0.60) NR1I2SMARCA2SMARCA4PBRM1BRD4
SCHEMBL27651172 0.63 IDO1 (0.42) NR1I2SMARCA2SMARCA4PBRM1BRD4
SCHEMBL29623192 0.63 ALDH1A1 (0.67) SMN1; SMN2HSD17B10ALDH1A1LMNAHPGD
SCHEMBL30442890 0.63 ALDH1A1 (0.67) SMN1; SMN2HSD17B10ALDH1A1LMNAHPGD

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