SCHEMBL21516639

SCHEMBL21516639

Cc1cc(N2CCCCCC2c2cc(N3CCCC3=O)ccc2Cl)nc(N)n1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FFAR1 O14842 11/20 0.38
FFAR4 Q5NUL3 11/20 0.38
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
AKR1C3 P42330 5/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL21491292 0.87 KDM4E (0.39) CRHBPCRHR2SMN1; SMN2FFAR1FFAR4
SCHEMBL29456443 0.87 KDM4E (0.39) CRHBPCRHR2SMN1; SMN2FFAR1FFAR4
SCHEMBL24313515 0.86 CRHBP (0.50) CRHBPCRHR2SMN1; SMN2ALDH1A1KDM4E
SCHEMBL24313097 0.83 CRHBP (0.47) CRHBPCRHR2SMN1; SMN2ALDH1A1KDM4E
SCHEMBL24313458 0.81 CRHBP (0.42) CRHBPCRHR2SMN1; SMN2ALDH1A1KDM4E
SCHEMBL24313314 0.81 CRHBP (0.45) CRHBPCRHR2SMN1; SMN2
SCHEMBL21491330 0.80 CRHBP (0.48) CRHBPCRHR2SMN1; SMN2KDM4EHTT
SCHEMBL21491331 0.80 CRHBP (0.48) CRHBPCRHR2SMN1; SMN2KDM4EHTT
SCHEMBL21491441 0.80 CRHBP (0.48) CRHBPCRHR2SMN1; SMN2KDM4EHTT
SCHEMBL29456542 0.80 CRHBP (0.48) CRHBPCRHR2SMN1; SMN2KDM4EHTT

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-10815225-B2 Antiproliferation compounds and uses thereof MERCK PATENT GMBH (DE) 2020-10-27 US disclosed
US-20190322658-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-10-24 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 (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-20190322658-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MKI67, MCL1, CCNI CRHBP 4181/4885CRHR2 4068/4885SMN1; SMN2 2714/4885
US-10815225-B2 Antiproliferation compounds and uses thereof MKI67, MCL1, CCNI CRHBP 4181/4885CRHR2 4068/4885SMN1; SMN2 2714/4885

“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.