SCHEMBL16763370

SCHEMBL16763370

OC1CCC(n2c(CCl)nc3cc(Cl)ccc32)C1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.43
KMT2A Q03164 1/20 0.39
MCHR1 Q99705 5/20 0.39
KCNH2 Q12809 1/20 0.39
FPR2 P25090 1/20 0.39
EP300 Q09472 2/20 0.38
TBXA2R P21731 3/20 0.38
BACE1 P56817 2/20 0.38
NUDT1 P36639 1/20 0.38
HDAC6 Q9UBN7 1/20 0.36
JAK2 O60674 2/20 0.36
JAK1 P23458 2/20 0.36
CCR3 P51677 1/20 0.36

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
SCHEMBL15416360 0.92 CYP11B2 (0.47) CYP11B2KMT2AMCHR1KCNH2FPR2
SCHEMBL16763611 0.92 CYP11B2 (0.47) CYP11B2KMT2AMCHR1KCNH2FPR2
SCHEMBL15415872 0.79 PDE10A (0.44) CYP11B2MCHR1KCNH2EP300JAK2
SCHEMBL15416560 0.79 CYP11B2 (0.41) CYP11B2KMT2AMCHR1KCNH2FPR2
SCHEMBL24165560 0.78 CYP11B2 (0.46) CYP11B2KMT2AMCHR1KCNH2FPR2
SCHEMBL15415417 0.77 CYP11B2 (0.40) CYP11B2MCHR1KCNH2JAK2CCR3
SCHEMBL16512912 0.77 CCR3 (0.48) CYP11B2MCHR1KCNH2FPR2BACE1
SCHEMBL18807889 0.77 CYP11B2 (0.43) CYP11B2MCHR1KCNH2FPR2TBXA2R
SCHEMBL22495117 0.77 FPR2 (0.47) CYP11B2FPR2EP300TBXA2RHDAC6
SCHEMBL19470928 0.76 CYP11B2 (0.49) CYP11B2MCHR1KCNH2EP300CCR3

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-2872502-B1 NOVEL INDAZOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION HOFFMANN LA ROCHE (CH) 2016-08-24 EP disclosed
US-20160200741-A1 Novel indazoles for the treatment and prophylaxis of respiratory syncytial virus infection HOFFMANN-LA ROCHE INC. (US) 2016-07-14 US disclosed
US-9206191-B2 Indazoles for the treatment and prophylaxis of respiratory syncytial virus infection HOFFMANN-LA ROCHE INC. (US) 2015-12-08 US disclosed
US-20150158879-A1 Novel indazoles for the treatment and prophylaxis of respiratory syncytial virus infection HOFFMANN-LA ROCHE INC. (US) 2015-06-11 US 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 (2 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-20150158879-A1 Novel indazoles for the treatment and prophylaxis of respiratory syncytial virus infection ADORA3, ADORA1, BRS3 CYP11B2 526/4885KMT2A 2954/4885MCHR1 1636/4885
US-20160200741-A1 Novel indazoles for the treatment and prophylaxis of respiratory syncytial virus infection ADORA3, ADORA1, BRS3 CYP11B2 526/4885KMT2A 2954/4885MCHR1 1636/4885

“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.