SCHEMBL1223653

SCHEMBL1223653

c1nnnn1C1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.38
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 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
SCHEMBL8388948 0.98 IDO1 (0.37) IDO1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL14917493 0.90
SCHEMBL23834982 0.80 SMYD3 (0.36) IDO1
SCHEMBL21789269 0.80 SMYD3 (0.36) IDO1
Hydrochloric Acid SCHEMBL21774820 0.79 SMYD3 (0.36) IDO1
Hydrochloric Acid SCHEMBL21774821 0.79 SMYD3 (0.36) IDO1
SCHEMBL12313120 0.74 IDO1 (0.40) IDO1
SCHEMBL1971343 0.74 KMT2A (0.36) IDO1ALDH1A1MEN1KMT2A
SCHEMBL12436840 0.73 KCNJ1 (0.33) IDO1ALDH1A1
SCHEMBL30103385 0.71 CYP2C19 (0.35) ALDH1A1MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7884118-B2 such as 1-Cyclopentyl-5-iodotetrazole, suitable as microbicides for protecting plants and materials LANXESS DEUTSCHLAND GMBH (DE) 2011-02-08 US disclosed
US-20090042960-A1 1-Cycloalkyl-5-Iodotetrazoles LANXESS DEUTSCHLAND GMBH (DE) 2009-02-12 US disclosed
EP-1904464-A1 1-CYCLOALKYL-5-IODOTETRAZOLES Lanxess Deutschland GmbH (DE) 2008-04-02 EP disclosed
WO-2007025586-A1 1-CYCLOALKYL-5-IODOTETRAZOLES LANXESS DEUTSCHLAND GMBH (DE) 2007-03-08 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 (1 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-20090042960-A1 1-Cycloalkyl-5-Iodotetrazoles MSR1, CYP51A1, MCL1 IDO1 24/4885ALDH1A1 314/4885SMN1; SMN2 4374/4885

“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.