SCHEMBL19251107

SCHEMBL19251107

CCCC(C)(C)c1cncc(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 0.35
CHRNA4 P43681 5/20 0.35
CYP19A1 P11511 4/20 0.35
HCAR2 Q8TDS4 1/20 0.32
CYP11B2 P19099 3/20 0.32
CYP11B1 P15538 2/20 0.32
CHRNA1 P02708 1/20 0.32
CHRNA7 P36544 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
CHRNB4 P30926 2/20 0.30
CHRNA3 P32297 2/20 0.30

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
SCHEMBL19251108 0.89 CNR2 (0.38) CHRNB2CHRNA4CYP19A1CNR1CNR2
SCHEMBL22752547 0.86 CNR2 (0.45) CNR1CNR2
SCHEMBL19633835 0.86 CNR2 (0.35) CNR1CNR2
SCHEMBL19558165 0.85 CYP19A1 (0.41) CHRNB2CHRNA4CYP19A1HCAR2CYP11B2
SCHEMBL19274420 0.81 CNR2 (0.33) CNR1CNR2
SCHEMBL22752535 0.80 TLR8 (0.33) CHRNB2CHRNA4CYP19A1
SCHEMBL21902013 0.79 CYP19A1 (0.35) CHRNB2CHRNA4CYP19A1HCAR2CYP11B2
SCHEMBL18516838 0.79 CNR2 (0.36) CHRNB2CHRNA4HCAR2CYP11B2CYP11B1
SCHEMBL18856535 0.78 SCN5A (0.35) CYP19A1CNR1CNR2
SCHEMBL18531480 0.78 CNR2 (0.37) CNR1CNR2

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
US-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-11 US disclosed
US-10858360-B2 Tricyclic gyrase inhibitors MERCK SHARP & DOHME CORP. (US) 2020-12-08 US disclosed
US-9809545-B2 Factor XIa inhibitors MERCK SHARP & DOHME CORP. (US) 2017-11-07 US disclosed
US-9732083-B2 Tricyclic gyrase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-08-15 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-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME SLC10A1, NR1H4, SLC10A2 CHRNB2 4864/4885CHRNA4 4668/4885CYP19A1 503/4885
US-10858360-B2 Tricyclic gyrase inhibitors TOP1, TOP2A, TOP2B CHRNB2 4657/4885CHRNA4 4715/4885CYP19A1 293/4885

“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.