SCHEMBL8935238

SCHEMBL8935238

NCC(=O)NCc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.67
BCHE P06276 1/20 0.61
HPGD P15428 1/20 0.60
KMT2A Q03164 1/20 0.60
ADAMTS5 Q9UNA0 1/20 0.60
GID4 Q8IVV7 1/20 0.58
TSHR P16473 1/20 0.57
RECQL P46063 1/20 0.57
ALDH1A1 P00352 1/20 0.57
MAOB P27338 1/20 0.57
PARP10 Q53GL7 1/20 0.56

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
SCHEMBL8389369 0.88 NPC1 (0.71) BCHEHPGDKMT2AADAMTS5GID4
SCHEMBL13652546 0.87 LMNA (0.61) BCHEHPGDKMT2AADAMTS5GID4
SCHEMBL7350528 0.86 ALDH1A1 (0.63) BCHEHPGDKMT2AADAMTS5GID4
SCHEMBL26633561 0.86 BCHE (0.67) BCHEKMT2AADAMTS5
SCHEMBL8575115 0.85 LTA4H (0.63) LTA4HBCHE
SCHEMBL417953 0.85 AOC3 (0.72) HPGDKMT2ATSHRRECQLALDH1A1
SCHEMBL10133176 0.85 NPC1 (0.67) BCHEHPGDKMT2AADAMTS5GID4
Iodomethane SCHEMBL8387414 0.84 NPC1 (0.70) BCHEHPGDKMT2AADAMTS5GID4
SCHEMBL8935243 0.84 GID4 (0.74) KMT2AGID4ALDH1A1MAOB
Bromide SCHEMBL10352605 0.84 AOC3 (0.70) HPGDKMT2ATSHRRECQLALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5502079-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-03-26 US disclosed
CN-1027588-C Process for the preparation of N-phenylalkyl substituted alpha-aminocarboxamide derivatives ERBA CARLO SPA (IT) 1995-02-08 CN disclosed
CN-1047496-A The preparation method of the alpha-amino group Carboxylamide derivatives that N-benzene alkyl replaces ERBA CARLO SPA (IT) 1990-12-05 CN disclosed