SCHEMBL23946257

SCHEMBL23946257

CCc1nc2ccc(F)cc2n1C1CC1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 19/20 0.58
CYP11B1 P15538 12/20 0.58
ADRB1 P08588 1/20 0.49
ADRA2A P08913 1/20 0.49
CYP19A1 P11511 1/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49
HTR2C P28335 1/20 0.49
HTR2B P41595 1/20 0.49
CCR3 P51677 1/20 0.47

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
SCHEMBL3292500 0.80 CCR3 (0.74) CYP11B2CYP11B1CCR3
Hydrochloric Acid SCHEMBL31587305 0.79 CCR3 (0.72) CYP11B2CYP11B1CCR3
SCHEMBL22623697 0.78 LMNA (0.50) CYP11B2
SCHEMBL14417403 0.77 CYP11B1 (0.46) CYP11B2CYP11B1
SCHEMBL22219432 0.77 CYP11B2 (0.58) CYP11B2CYP11B1ADRB1ADRA2ACYP19A1
SCHEMBL29406343 0.77 CYP11B2 (0.58) CYP11B2CYP11B1ADRB1ADRA2ACYP19A1
SCHEMBL12196520 0.77 CCNT1 (0.55) CYP11B2CYP11B1ADRB1ADRA2ACYP19A1
SCHEMBL21277661 0.75 CRHBP (0.47)
SCHEMBL21390948 0.75 CYP11B2 (0.59) CYP11B2CYP11B1ADRB1ADRA2ACYP19A1
SCHEMBL2508606 0.74 PIK3CD (0.55) CYP11B2CYP11B1ADRB1ADRA2ACYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210322409-A1 METALLOENZYME INHIBITOR COMPOUNDS SELENITY THERAPEUTICS (BERMUDA), LTD. (BM) 2021-10-21 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 (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-20210322409-A1 METALLOENZYME INHIBITOR COMPOUNDS SOD1, RNASE1, FECH CYP11B2 405/4885CYP11B1 370/4885ADRB1 4658/4885

“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.