SCHEMBL3168264

SCHEMBL3168264

[CH2]CNc1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
IDO1 P14902 1/20 0.48
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
ADRA2B P18089 1/20 0.43
ADRA2C P18825 1/20 0.43
LMNA P02545 3/20 0.41
TSHR P16473 2/20 0.41
EPHB3 P54753 1/20 0.40
IGF1R P08069 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP1A2 P05177 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CXCL8 P10145 1/20 0.39
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ROCK2 O75116 1/20 0.37

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
Ethylene SCHEMBL1818626 0.81 MAPT (0.48) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL328847 0.80 MAPT (0.52) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL9421891 0.80 MAPT (0.52) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL29415424 0.80 MAPT (0.52) MAPTIDO1MEN1KMT2AADRA2B
Ammonia Solution, Strong SCHEMBL8970822 0.78 MAPT (0.50) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL1116563 0.76 IDO1 (0.48) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL12651876 0.76 IDO1 (0.48) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL13446854 0.76 MAPT (0.48) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL8030801 0.76 HPGD (0.47) MAPTIDO1MEN1KMT2AADRA2B
SCHEMBL11509957 0.74 MEN1 (0.50) MAPTIDO1MEN1KMT2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8741934-B2 Inhibitors of ion channels PFIZER LIMITED (GB) 2014-06-03 US disclosed
US-20130072471-A1 Inhibitors of Ion Channels MARRON BRIAN EDWARD (US) 2013-03-21 US disclosed
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
EP-1995241-B1 Inhibitors of ion channels ICAGEN INC (US) 2010-03-17 EP disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 US disclosed
EP-1995241-A1 Inhibitors of ion channels ICAgen, Incorporated (US) 2008-11-26 EP disclosed
WO-2008118758-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (GB) 2008-10-02 WO 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 (2 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-20130072471-A1 Inhibitors of Ion Channels TRPV1, TRPV5, TRPA1 MAPT 2938/4885IDO1 2615/4885MEN1 4729/4885
US-20090143358-A1 INHIBITORS OF ION CHANNELS TRPV1, TRPV5, TRPA1 MAPT 2938/4885IDO1 2615/4885MEN1 4729/4885

“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.