SCHEMBL21483544

SCHEMBL21483544

Cc1cccc(N(C)CCN2CCOCC2)c1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 8/20 0.60
TSHR P16473 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
RECQL P46063 1/20 0.46
LMNA P02545 1/20 0.45
HSD17B10 Q99714 1/20 0.44
ICMT O60725 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL3235991 0.84 HTR7 (0.50) HTR7ALDH1A1
SCHEMBL24737221 0.83 HTR7 (0.49) HTR7ALDH1A1
SCHEMBL11440371 0.83 HTR7 (0.53) HTR7LMNAHSD17B10ALDH1A1
SCHEMBL19611198 0.82 HTR7 (0.52) HTR7TSHRRECQLLMNAALDH1A1
SCHEMBL21479413 0.82 HTR7 (0.48) HTR7LMNAALDH1A1
SCHEMBL13103802 0.82 POLB (0.48) TSHRRECQLALDH1A1
SCHEMBL3235980 0.79 HTR7 (0.48) HTR7L3MBTL1ALDH1A1
SCHEMBL23373499 0.79 ALDH1A1 (0.46) HTR7LMNAALDH1A1
SCHEMBL19611197 0.77 MAPT (0.49) HTR7L3MBTL1RECQLALDH1A1
SCHEMBL11138993 0.76 HTR7 (0.51) HTR7LMNAICMTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954242-B2 Bicyclic urea kinase inhibitors and uses thereof THE BROAD INSTITUTE, INC. (US) 2021-03-23 US disclosed
US-20200317675-A9 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2020-10-08 US disclosed
US-20190315752-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2019-10-17 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 (3 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-20200317675-A9 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF SIK1, SIK2, SIK3 HTR7 2813/4885TSHR 4652/4885L3MBTL1 3255/4885
US-20190315752-A1 BICYCLIC UREA KINASE INHIBITORS AND USES THEREOF SIK1, SIK2, SIK3 HTR7 2813/4885TSHR 4652/4885L3MBTL1 3255/4885
US-10954242-B2 Bicyclic urea kinase inhibitors and uses thereof SIK1, SIK2, SIK3 HTR7 2813/4885TSHR 4652/4885L3MBTL1 3255/4885

“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.