SCHEMBL5705114

SCHEMBL5705114

CC(=O)N1C=CC(c2c[nH]c3ccc(OCc4ccccc4)cc23)C=C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
LTA4H P09960 6/20 0.50
PLA2G2A P14555 6/20 0.50
TRPM8 Q7Z2W7 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPT P10636 2/20 0.50
HSP90AA1 P07900 1/20 0.50
HSP90AB1 P08238 1/20 0.50
HTR1D P28221 3/20 0.47
SLC6A4 P31645 1/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MDH2 P40926 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.45
LMNA P02545 1/20 0.43

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
SCHEMBL9837468 0.82 MTNR1A (0.56) CYP1A2CYP3A4CYP2C19MEN1KMT2A
SCHEMBL5705170 0.79 KDM4E (0.62) CYP1A2CYP3A4CYP2C19LTA4HPLA2G2A
SCHEMBL11440068 0.76 F7 (0.47) TRPM8SLC6A4HSD17B10
SCHEMBL6764594 0.76 MAOB (0.61) LTA4HPLA2G2ATRPM8MEN1KMT2A
SCHEMBL6101206 0.73 LTA4H (0.56) LTA4HPLA2G2ATRPM8MEN1KMT2A
SCHEMBL5363538 0.72 CYP1A2 (0.60) CYP1A2CYP3A4CYP2C19TRPM8KDM4E
SCHEMBL26863407 0.72 TRPM8 (0.56) CYP1A2CYP3A4CYP2C19LTA4HPLA2G2A
SCHEMBL5879349 0.72 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C19LTA4HPLA2G2A
SCHEMBL852462 0.72 TRPM8 (0.55) CYP1A2CYP3A4CYP2C19LTA4HPLA2G2A
SCHEMBL4573946 0.72 TRPM8 (0.69) LTA4HPLA2G2ATRPM8MEN1KMT2A

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
EP-1691807-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF BONE DISEASES Astellas Pharma Inc. (JP) 2006-08-23 EP disclosed
US-20050245540-A1 New methods FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
WO-2005056012-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF BONE DISEASES ASTELLAS PHARMA INC. (JP) 2005-06-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050245540-A1 New methods TGFB1, TGFBR1, TGFB2 CYP1A2 1352/4885CYP3A4 2814/4885CYP2C19 2643/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.