SCHEMBL7870131

SCHEMBL7870131

C[C@H](N)C(=O)Oc1ccc(C(=O)[C@@H](C)N)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.55
PARP10 Q53GL7 3/20 0.42
KMT2A Q03164 4/20 0.39
PRSS1 P07477 1/20 0.38
ACR P10323 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
MEN1 O00255 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
PARP1 P09874 1/20 0.37
PARP2 Q9UGN5 1/20 0.37
PARP4 Q9UKK3 1/20 0.37
ESR1 P03372 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL8681157 1.00 ELANE (0.55) ELANEPARP10KMT2APRSS1ACR
SCHEMBL15679080 0.88 ELANE (0.55) ELANEPARP10KMT2AALDH1A1CYP1A2
SCHEMBL23493150 0.88 ELANE (0.55) ELANEPARP10KMT2AALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL30184762 0.86 ELANE (0.53) ELANEPARP10KMT2AALDH1A1CYP1A2
SCHEMBL364405 0.85 KMT2A (0.56) ELANEPARP10KMT2AALDH1A1CA1
SCHEMBL1061790 0.85 ELANE (0.55) ELANEPARP10KMT2ASMN1; SMN2
SCHEMBL27274105 0.85 PARP10 (0.59) ELANEPARP10KMT2AALDH1A1CA1
SCHEMBL9705936 0.82 ELANE (0.45) ELANEPARP10KMT2APRSS1ALDH1A1
SCHEMBL10340366 0.82 ELANE (0.45) ELANEPARP10KMT2APRSS1ALDH1A1
SCHEMBL4806554 0.82 PRSS1 (0.52) ELANEPRSS1

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-0882768-B1 Method for producing of phthalocyanine compound NIPPON CATALYTIC CHEM IND (JP) 2001-12-19 EP disclosed
US-6034236-A REACTING A PHTHALONITRILE WITH A METAL OXIDE IN PRESENCE OF A SULFONIC ACID CATALYST NIPPON SHOKUBAI CO., LTD. (JP) 2000-03-07 US disclosed
EP-0882768-A2 Method for producing of phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 1998-12-09 EP disclosed
US-3948821-A Solid amino acid products for polypeptide synthesis and method of manufacture thereof ROHM AND HAAS COMPANY (US) 1976-04-06 US disclosed