SCHEMBL23745799

SCHEMBL23745799

Cc1cccc(C(CCNC2CCNCC2)c2cn(CC3CCCCC3)c3ccc(Br)cc23)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 2/20 0.43
ABCC2 Q92887 1/20 0.34
CNR1 P21554 6/20 0.34
CYP19A1 P11511 2/20 0.34
CNR2 P34972 2/20 0.33
ICMT O60725 1/20 0.33
MPO P05164 1/20 0.32
MC4R P32245 1/20 0.31
MAPK8 P45983 1/20 0.31
IDO1 P14902 1/20 0.30
EPHX2 P34913 1/20 0.30
KRAS P01116 1/20 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
Hydrochloric Acid SCHEMBL23722188 0.99 SOS1 (0.42) SOS1ABCC2CNR1CYP19A1CNR2
SCHEMBL23745604 0.92 CNR2 (0.42) SOS1CNR1CYP19A1CNR2ICMT
Hydrochloric Acid SCHEMBL23722144 0.92 CNR2 (0.41) SOS1CNR1CYP19A1CNR2ICMT
SCHEMBL23745593 0.91 CNR1 (0.34) SOS1ABCC2CNR1CYP19A1CNR2
SCHEMBL23745636 0.90 SOS1 (0.48) SOS1ABCC2CNR1ICMTMPO
Hydrochloric Acid SCHEMBL23722002 0.90 CNR1 (0.34) SOS1ABCC2CNR1CYP19A1CNR2
Hydrochloric Acid SCHEMBL23722065 0.90 SOS1 (0.47) SOS1ABCC2CNR1ICMTMPO
SCHEMBL23745637 0.88 SOS1 (0.41) SOS1CNR1CNR2ICMT
Hydrochloric Acid SCHEMBL23722051 0.87 SOS1 (0.40) SOS1CNR1CNR2ICMT
SCHEMBL23745514 0.86 SOS1 (0.48) SOS1CNR1CYP19A1ICMTMPO

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-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF BIOIMICS AB (SE) 2021-08-12 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-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF FDPS, FPR1, F12 SOS1 2902/4885ABCC2 715/4885CNR1 1651/4885

“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.