SCHEMBL30905935

SCHEMBL30905935

O=c1[nH]ncc2cc(N3CCNCC3)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR3E A5X5Y0 2/20 0.49
▸ HTR3B O95264 2/20 0.49
▸ HTR3A P46098 2/20 0.49
▸ HTR3D Q70Z44 2/20 0.49
▸ HTR3C Q8WXA8 2/20 0.49
▸ SIGMAR1 Q99720 2/20 0.49
▸ HTR5A P47898 1/20 0.49
▸ CDC7 O00311 1/20 0.46
▸ PARP1 P09874 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ PRKCI P41743 1/20 0.45
▸ PDE4B Q07343 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ PIM1 P11309 4/20 0.44
▸ PIM3 Q86V86 4/20 0.44
▸ ADRB1 P08588 3/20 0.43
▸ HTR1A P08908 2/20 0.43
▸ PIM2 Q9P1W9 2/20 0.43
▸ METAP2 P50579 1/20 0.43

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
SCHEMBL30544687 0.84 POLB (0.49) HTR3APARP1HSD17B10ALDH1A1PRKCI
SCHEMBL30544684 0.84 PIK3CD (0.53) PARP1HSD17B10ALDH1A1PRKCIPDE4B
SCHEMBL30544653 0.79 TIPARP (0.45) PARP1HSD17B10ALDH1A1PRKCIPDE4B
SCHEMBL2798618 0.79 CDC7 (0.59) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL22412381 0.78 CDC7 (0.58) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL30544700 0.78 PIM1 (0.42) PARP1HSD17B10ALDH1A1PRKCIPDE4B
SCHEMBL30985122 0.77 PARP1 (0.38) CDC7PARP1HSD17B10ALDH1A1PRKCI
SCHEMBL31330785 0.76 HTR1A (0.45) HTR3AHSD17B10ALDH1A1HTR1AHTR1D
SCHEMBL29539832 0.76 PDGFRB (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2799745 0.76 PDGFRB (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C

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
WO-2024112119-A1 DEGRADER FOR DECOMPOSING CMET PROTEIN, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 이노큐어테라퓨틱스 2024-05-30 — — WO disclosed
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