SCHEMBL7274089

SCHEMBL7274089

CCCCCCCCOc1ccc(C[C]=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.56
TP53 P04637 2/20 0.54
TSHR P16473 1/20 0.54
PLA2G4B P0C869 2/20 0.53
KDM4E B2RXH2 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
PDE4A P27815 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HIF1A Q16665 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MMP2 P08253 1/20 0.51
MMP3 P08254 1/20 0.51
MMP9 P14780 1/20 0.51
PLA2G2A P14555 1/20 0.51
RARB P10826 3/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL11311467 1.00 NR5A1 (0.56) NR5A1TP53TSHRPLA2G4BKDM4E
SCHEMBL9272018 1.00 NR5A1 (0.56) NR5A1TP53TSHRPLA2G4BKDM4E
SCHEMBL11198912 1.00 NR5A1 (0.56) NR5A1TP53TSHRPLA2G4BKDM4E
SCHEMBL1367833 0.95 SMN1; SMN2 (0.56) NR5A1TSHRKDM4ECYP1A2CYP2D6
SCHEMBL910937 0.87 LMNA (0.53) KDM4ECYP1A2CYP2D6PDE4ASMN1; SMN2
SCHEMBL9265038 0.83 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4BSMN1; SMN2
SCHEMBL11307452 0.83 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4BSMN1; SMN2
SCHEMBL7276095 0.83 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4BSMN1; SMN2
SCHEMBL11319335 0.83 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4BSMN1; SMN2
SCHEMBL11311492 0.83 NR5A1 (0.53) NR5A1TP53TSHRPLA2G4BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4297277-A FUNGICIDES ANTISEPTICS ELI LILLY AND COMPANY (US) 1981-10-27 US claimed
US-4293486-A ANTIFUNGAL PEPTIDES ELI LILLY AND COMPANY (US) 1981-10-06 US claimed
US-4293484-A ANTIFUNGAL PEPTIDES ELI LILLY AND COMPANY (US) 1981-10-06 US claimed
US-4293489-A ANTIFUNGAL PEPTIDES ELI LILLY AND COMPANY (US) 1981-10-06 US claimed
US-4289692-A CYCLIC PEPTIDE ANTIBIOTICS ELI LILLY AND COMPANY (US) 1981-09-15 US claimed
EP-0031220-A1 Derivatives of cyclic peptide nuclei ELI LILLY AND COMPANY (US) 1981-07-01 EP claimed
CN-1040541-C Polypeptide compound and process for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1998-11-04 CN disclosed
US-H1638-H CYCLIC HEXAPEPTIDE FURUTA TAKAHISA (JP) 1997-03-04 US disclosed
EP-0462531-B1 Cyclic polypeptide with antibiotic activity, process for its preparation and pure culture of a Coelomycetes strain FUJISAWA PHARMACEUTICAL CO (JP) 1996-10-02 EP disclosed
EP-0729974-A1 Cyclic polypeptide with antibiotic activity and a process for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-09-04 EP disclosed
US-5376634-A Microbiocides FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-12-27 US disclosed
EP-0486011-A2 Pharmaceutical composition against Pneumocystis carinii FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-05-20 EP disclosed
CN-1059729-A Novel polypeptide compound and preparation method thereof FUJISAWA PHARMACEUTICAL CO (JP) 1992-03-25 CN disclosed
EP-0462531-A2 Cyclic polypeptide with antibiotic activity, process for its preparation and pure culture of a Coelomycetes strain FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-27 EP disclosed
US-4297277-A FUNGICIDES ANTISEPTICS ELI LILLY AND COMPANY (US) 1981-10-27 US disclosed
US-4293484-A ANTIFUNGAL PEPTIDES ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed
US-4293486-A ANTIFUNGAL PEPTIDES ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed
US-4289692-A CYCLIC PEPTIDE ANTIBIOTICS ELI LILLY AND COMPANY (US) 1981-09-15 US disclosed
EP-0031220-A1 Derivatives of cyclic peptide nuclei ELI LILLY AND COMPANY (US) 1981-07-01 EP disclosed