SCHEMBL31294822

SCHEMBL31294822

NC1(c2cccc(Cl)n2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
CYP3A4 P08684 1/20 0.38
HTR3E A5X5Y0 3/20 0.36
HTR3B O95264 3/20 0.36
HTR3A P46098 3/20 0.36
HTR3D Q70Z44 3/20 0.36
HTR3C Q8WXA8 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 1/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
ALDH1A1 P00352 4/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
IDH1 O75874 3/20 0.32
IDH2 P48735 3/20 0.32
PARP1 P09874 1/20 0.31
NSD2 O96028 3/20 0.31
KDM4E B2RXH2 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
SCHEMBL2392603 1.00 TSHR (0.38) TSHRCYP3A4HTR3EHTR3BHTR3A
SCHEMBL30912571 0.75 IRAK4 (0.34) IRAK4PARP1
SCHEMBL20581549 0.75 IRAK4 (0.48) TSHRCYP3A4HTR3EHTR3BHTR3A
SCHEMBL10277702 0.75 HTR3E (0.34) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL29176163 0.75 HTR1A (0.38) TSHRCYP3A4HTR3EHTR3BHTR3A
SCHEMBL25410760 0.75 HTR3E (0.38) TSHRCYP3A4HTR3EHTR3BHTR3A
SCHEMBL22234901 0.72 HTR1A (0.42) TSHRCYP3A4HTR3EHTR3BHTR3A
SCHEMBL16742622 0.72 OPRM1 (0.41) TSHRCYP3A4HTR3EHTR3BHTR3A
SCHEMBL1492804 0.72 SLC6A3 (0.49)
SCHEMBL31294813 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4735423-A1 KV7 MODULATORS Saniona A/S (DK) 2026-05-06 EP disclosed
WO-2025003343-A1 KV7 MODULATORS SANIONA A/S (DK) 2025-01-02 WO disclosed