SCHEMBL30790976

SCHEMBL30790976

Clc1ncc2c(n1)CCNC2

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HTR2C P28335 13/20 0.48
HTR2B P41595 9/20 0.43
CYP3A4 P08684 1/20 0.40
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR3A P46098 1/20 0.39
HTR6 P50406 1/20 0.39
PNMT P11086 3/20 0.38
CD44 P16070 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL12878847 1.00 POLB (0.51) POLBSMN1; SMN2HTR2CHTR2BCYP3A4
Hydrochloric Acid SCHEMBL18550271 0.98 POLB (0.50) POLBSMN1; SMN2HTR2CHTR2BCYP3A4
Trifluoroacetic Acid SCHEMBL18550341 0.85 HTR2C (0.41) POLBSMN1; SMN2HTR2CHTR2BCYP3A4
SCHEMBL26640418 0.85 HTR2C (0.55) POLBSMN1; SMN2HTR2CHTR2BCHRM4
Hydrochloric Acid SCHEMBL26640478 0.84 HTR2C (0.54) POLBSMN1; SMN2HTR2CHTR2BCHRM4
SCHEMBL18818489 0.82 HTR2C (0.37) POLBSMN1; SMN2HTR2CHTR2B
Hydrochloric Acid SCHEMBL21591718 0.81 HTR2C (0.36) POLBSMN1; SMN2HTR2CHTR2B
SCHEMBL4135011 0.78 POLB (0.51) POLBSMN1; SMN2HTR2CHTR2BCYP3A4
SCHEMBL2449506 0.78 POLB (0.51) POLBSMN1; SMN2HTR2CHTR2BCYP3A4
SCHEMBL2183634 0.78 POLB (0.51) POLBSMN1; SMN2HTR2CHTR2BCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4572761-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2025-06-25 EP disclosed
CN-119730854-A Compounds and their use as PDE4 activators 米罗尼德有限公司 2025-03-28 CN disclosed
WO-2024038129-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2024-02-22 WO disclosed