Sugi Predict

Sugi Predict / Compounds / SCHEMBL11310258

SCHEMBL11310258

SCHEMBL11310258

ClCCCCCCN1CCCCC1.ICCCN1CCCCC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 12/20 0.60
▸ SIGMAR1 Q99720 1/20 0.41
▸ MAPT P10636 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6444053 0.89 HRH3 (0.75) HRH3SIGMAR1MAPTCYP1A2MAPK1
SCHEMBL6447947 0.89 HRH3 (0.75) HRH3SIGMAR1MAPTCYP1A2MAPK1
SCHEMBL6442289 0.89 HRH3 (0.75) HRH3SIGMAR1MAPTCYP1A2MAPK1
SCHEMBL6443349 0.89 HRH3 (0.75) HRH3SIGMAR1MAPTCYP1A2MAPK1
Hydrochloric Acid SCHEMBL10473504 0.87 HRH3 (0.71) HRH3SIGMAR1MAPTCYP1A2MAPK1
SCHEMBL6444083 0.87 HRH3 (0.70) HRH3SIGMAR1MAPTCYP1A2MAPK1
SCHEMBL6442159 0.87 HRH3 (0.70) HRH3SIGMAR1MAPTCYP1A2
SCHEMBL6443177 0.87 HRH3 (0.70) HRH3SIGMAR1MAPTCYP1A2
SCHEMBL2747040 0.87 HRH3 (0.70) HRH3SIGMAR1MAPTCYP1A2MAPK1
Hydrochloric Acid SCHEMBL7101066 0.85 HRH3 (0.67) HRH3SIGMAR1MAPTCYP1A2MAPK1

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
EP-0049779-A1 3-Aminoindazole derivatives and process for preparation thereof Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-04-21 — — EP disclosed