SCHEMBL2857170

SCHEMBL2857170

Clc1ccc(CNCCc2cccnc2)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 1/20 0.58
CYP1A2 P05177 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
ROCK1 Q13464 1/20 0.52
CHRM2 P08172 1/20 0.51
RAB9A P51151 1/20 0.51
NOS1 P29475 1/20 0.51
DYRK1A Q13627 1/20 0.48
CLK4 Q9HAZ1 1/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
SIGMAR1 Q99720 2/20 0.48
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL18768852 0.88 CYP1A2 (0.68) CYP1A2CYP2D6CHRM2RAB9ADYRK1A
SCHEMBL16606308 0.83 CYP1A2 (0.74) HTR5ACYP1A2CYP2D6CHRM2ALDH1A1
SCHEMBL2854484 0.82 CYP1A2 (0.68) CYP1A2CYP2D6CYP2C9CYP2C19ROCK1
SCHEMBL13355443 0.82 RAB9A (0.63) RAB9ACLK4ALDH1A1MEN1LMNA
SCHEMBL18768843 0.82 CYP1A2 (0.71) CYP1A2CYP2D6CYP2C9CYP2C19ROCK1
SCHEMBL10561741 0.81 CYP1A2 (0.61) HTR5ACYP1A2CYP2D6CHRM2ALDH1A1
SCHEMBL1238008 0.79 CYP1A2 (0.61) HTR5ACYP1A2CYP2D6CHRM2NOS1
SCHEMBL16038317 0.78 NOS1 (0.55) HTR5ACYP1A2CYP2D6ROCK1CHRM2
SCHEMBL27569236 0.78 CYP1A2 (0.56) HTR5ACYP1A2CYP2D6CHRM2NOS1
SCHEMBL16606311 0.78 CYP1A2 (0.63) HTR5ACYP1A2CYP2D6CHRM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3363288-B1 COMPOSITION FOR DESTRUCTION OF MICROALGAE OR MOSSES CUREARTH INC (KR) 2022-09-07 EP disclosed
CN-108347925-B Compositions for destroying microalgae or moss 株式会社CUREARTH 2021-07-16 CN disclosed
US-11044909-B2 Composition for destruction of microalgae or sphaerocarpus CUREARTH, INC. (KR) 2021-06-29 US disclosed
US-11044909-B2 Composition for destruction of microalgae or sphaerocarpus CUREARTH, INC. (KR) 2021-06-29 US disclosed
US-20180271091-A1 COMPOSITION FOR DESTRUCTION OF MICROALGAE OR SPHAEROCARPUS CUREARTH, INC. (KR) 2018-09-27 US disclosed
EP-3363288-A1 COMPOSITION FOR DESTRUCTION OF MICROALGAE OR SPHAEROCARPUS Curearth, Inc. (KR) 2018-08-22 EP disclosed
CN-108347925-A composition for destroying microalgae or moss 株式会社CUREARTH 2018-07-31 CN disclosed
WO-2017065401-A1 COMPOSITION FOR DESTRUCTION OF MICROALGAE OR SPHAEROCARPUS 주식회사 큐얼스 2017-04-20 WO disclosed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP disclosed
US-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES ICAGEN, INC. (US) 2008-03-13 US disclosed
US-7223782-B2 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2007-05-29 US disclosed
US-20050049237-A1 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2005-03-03 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 (4 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-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES SCN3A, TRPV3, HCN3 HTR5A 1438/4885CYP1A2 1874/4885CYP2D6 2653/4885
US-20050049237-A1 Pyrazole-amides and -sulfonamides SCN3A, TRPV3, HCN3 HTR5A 1438/4885CYP1A2 1874/4885CYP2D6 2653/4885
US-20180271091-A1 COMPOSITION FOR DESTRUCTION OF MICROALGAE OR SPHAEROCARPUS TK1, TRHDE, TK2 HTR5A 4306/4885CYP1A2 4399/4885CYP2D6 4332/4885
US-11044909-B2 Composition for destruction of microalgae or sphaerocarpus TK1, TRHDE, TK2 HTR5A 4306/4885CYP1A2 4399/4885CYP2D6 4332/4885

“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.