SCHEMBL7056738

SCHEMBL7056738

CCc1[nH]c2cc(OC)ccc2c1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.48
HTR1D P28221 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR1E P28566 1/20 0.48
HTR7 P34969 1/20 0.48
HTR5A P47898 1/20 0.48
HTR6 P50406 1/20 0.48
MTNR1A P48039 2/20 0.47
MTNR1B P49286 2/20 0.47
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TUBB4A P04350 2/20 0.46
TUBB P07437 2/20 0.46
TUBA3C P0DPH7 2/20 0.46
TUBA1B P68363 2/20 0.46
TUBA4A P68366 2/20 0.46
TUBB4B P68371 2/20 0.46

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
SCHEMBL10444002 0.81 MTNR1A (0.67) HTR1AHTR1DHTR2AHTR2CHTR1E
SCHEMBL3659426 0.77 KDM4E (0.60) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL7055922 0.76 TUBB1 (0.55) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL4568140 0.73 MRGPRX4 (0.46) MTNR1AMTNR1BKDM4ESMN1; SMN2GPR17
SCHEMBL3709905 0.72 TUBB4A (0.53) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL7256169 0.71 CTSV (0.66) KDM4EALDH1A1HPGDSMN1; SMN2KMT2A
SCHEMBL3698646 0.70 TUBB4A (0.51) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL8802574 0.70 MTNR1A (0.67) HTR1AHTR1DHTR2AHTR2CHTR1E
Hydroxyamine SCHEMBL5142517 0.69 PTPN5 (0.57) MTNR1AMTNR1BKDM4EALDH1A1SMN1; SMN2
SCHEMBL31744733 0.69 TUBB4A (0.65) HTR1AHTR1DHTR7HTR5AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0772592-B1 1H-INDOLE-1-FUNCTIONAL sPLA 2 INHIBITORS LILLY CO ELI (US) 2003-05-02 EP disclosed
EP-0772592-A4 1H-INDOLE-1-FUNCTIONAL sPLA 2? INHIBITORS LILLY CO ELI (US) 1998-07-08 EP disclosed
US-5641800-A ALLEVIATE EFFECT OF SEPTIC SHOCK, ADULT RESPIRATORY DISTRESS SYNDROME, PANCREATITIS, TRAUMA, BRONCHIAL ASTHMA, ALLERGIC RHINITIS, AND RHEUMATOID ARTHRITIS ELI LILLY AND COMPANY (US) 1997-06-24 US disclosed
EP-0772592-A1 1H-INDOLE-1-FUNCTIONAL sPLA 2? INHIBITORS ELI LILLY AND COMPANY (US) 1997-05-14 EP disclosed
WO-1996003376-A1 1H-INDOLE-1-FUNCTIONAL sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1996-02-08 WO disclosed