SCHEMBL23902154

SCHEMBL23902154

Cc1cc(COc2ccc(C3=NCCCN3)cc2C)cc(COc2ccc(C3=NCCCN3)cc2C)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 9/20 0.51
RUVBL1 Q9Y265 1/20 0.43
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
TOP2A P11388 2/20 0.40
TOP2B Q02880 2/20 0.40
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
S1PR1 P21453 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
SCHEMBL23901934 0.93 NISCH (0.49) NISCHFFAR1FFAR4S1PR1
SCHEMBL23901784 0.88 NISCH (0.49) NISCHRUVBL1GAATSHRTOP2A
SCHEMBL23566464 0.84 NISCH (0.58) NISCHRUVBL1GAATSHRTOP2A
Hydrochloric Acid SCHEMBL23541343 0.83 NISCH (0.57) NISCHGAATSHRTOP2ATOP2B
SCHEMBL23902206 0.82 F10 (0.40) NISCHS1PR1
SCHEMBL23902237 0.81 NISCH (0.51) NISCHS1PR1
SCHEMBL23901950 0.78 NISCH (0.54) NISCHGAATSHRTOP2ATOP2B
Hydrochloric Acid SCHEMBL23880708 0.77 NISCH (0.52) NISCHGAATSHRTOP2ATOP2B
SCHEMBL23566027 0.76 NISCH (0.56) NISCH
SCHEMBL23901805 0.76 NISCH (0.65) NISCHGAATSHRTOP2ATOP2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210309641-A1 AMIDINES AND AMIDINE ANALOGS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION ANTIBIOTICS GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2021-10-07 US disclosed
US-9562127-B2 Methods of forming block polymers for directed self-assembly INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2017-02-07 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 (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-20210309641-A1 AMIDINES AND AMIDINE ANALOGS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION ANTIBIOTICS PAM, AMPD1, AMPD3 NISCH 24/4885RUVBL1 3197/4885GAA 885/4885

“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.