SCHEMBL24352736

SCHEMBL24352736

SNCc1ccccc1-c1cccnn1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 3/20 0.42
▸ PDE9A O76083 1/20 0.36
▸ HTR2C P28335 6/20 0.35
▸ HTR2A P28223 2/20 0.35
▸ GOT1 P17174 1/20 0.32
▸ GPR84 Q9NQS5 2/20 0.32
▸ ROCK2 O75116 1/20 0.32
▸ ROCK1 Q13464 1/20 0.32
▸ CDC42BPB Q9Y5S2 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ KCNA5 P22460 1/20 0.32
▸ P2RX7 Q99572 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ OPRK1 P41145 1/20 0.31

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
SCHEMBL24352277 0.85 LTA4H (0.45) CASP6PDE9AHTR2CHTR2AROCK2
SCHEMBL24352816 0.81 CASP6 (0.39) CASP6PDE9AHTR2CHTR2AROCK2
SCHEMBL24352663 0.79 DPP4 (0.47) CASP6PDE9AHTR2CHTR2AGOT1
Hydrochloric Acid SCHEMBL29473282 0.77 DPP4 (0.46) CASP6PDE9AHTR2CHTR2AGOT1
SCHEMBL28680308 0.76 HTR2C (0.40) CASP6PDE9AHTR2CHTR2AHTR2B
SCHEMBL24352771 0.72 KCNA5 (0.51) KCNA5
SCHEMBL24352629 0.72 CYP1A2 (0.35) —
SCHEMBL8138036 0.68 IDO1 (0.44) CASP6HTR2CHTR2A
SCHEMBL3464878 0.68 NPC1 (0.45) HTR2CHTR2A
SCHEMBL10765944 0.68 IDO1 (0.46) HTR2CHTR2A

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-20220119395-A1 BICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2022-04-21 — — 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-20220119395-A1 BICYCLIC COMPOUNDS SLC10A1, PKD1, CYP11B2 CASP6 2981/4885PDE9A 614/4885HTR2C 1058/4885

“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.

Send feedback