SCHEMBL8630238

SCHEMBL8630238

Cc1ccccc1-c1nn[c]o1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.57
NPC1 O15118 11/20 0.57
SMN1; SMN2 Q16637 9/20 0.57
CASP3 P42574 2/20 0.57
SENP8 Q96LD8 2/20 0.57
SENP7 Q9BQF6 2/20 0.57
SENP6 Q9GZR1 2/20 0.57
HPGD P15428 4/20 0.49
TSHR P16473 4/20 0.49
ALDH1A1 P00352 4/20 0.49
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 4/20 0.42
PRNP P04156 1/20 0.42
PPARG P37231 1/20 0.42
MAPK10 P53779 1/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NOTUM Q6P988 1/20 0.42

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
SCHEMBL4448588 0.77 NPC1 (0.57) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL28563204 0.77 NOTUM (0.50) RAB9ANPC1SMN1; SMN2HPGDALDH1A1
SCHEMBL8629680 0.77 SMN1; SMN2 (0.46) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL3613332 0.77 ALDH1A1 (0.46) RAB9ANPC1SMN1; SMN2HPGDTSHR
SCHEMBL5267951 0.74 ALOX15 (0.47) RAB9ANPC1SMN1; SMN2HPGDTSHR
SCHEMBL7756394 0.73 RAB9A (1.00) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL11324245 0.70 L3MBTL1 (0.55) RAB9ANPC1CASP3SENP7ALDH1A1
SCHEMBL11187014 0.70 RAB9A (0.33) RAB9ANPC1SMN1; SMN2HPGDTSHR
SCHEMBL9361146 0.70 ESR1 (0.42) CASP3SENP8SENP7SENP6HPGD
SCHEMBL10034982 0.68 RAB9A (0.80) RAB9ANPC1SMN1; SMN2CASP3SENP8

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 8 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
US-4201779-A 7[(2-Amino-thiazol-4-yl)glyoxylamido]-cephem derivatives and processes for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1980-05-06 US disclosed
US-4016159-A BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DT) 1977-04-05 US disclosed