SCHEMBL21156537

SCHEMBL21156537

C=C(c1c(C)c(C(=O)OC(C)C)cc2cc(C3=CCOCC3)cn12)N1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
OPRK1 P41145 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
SCHEMBL21157353 0.84 SOS1 (0.37) SMN1; SMN2
SCHEMBL21157283 0.84 ALOX15 (0.41) ALDH1A1LMNASMN1; SMN2
SCHEMBL19964390 0.83 EED (0.39) ALDH1A1LMNASMN1; SMN2OPRK1
SCHEMBL19964936 0.83 EED (0.43)
SCHEMBL21157289 0.82 EZH2 (0.44) ALDH1A1LMNASMN1; SMN2OPRK1
SCHEMBL21156531 0.82 ALDH1A1 (0.40) ALDH1A1LMNASMN1; SMN2OPRK1
SCHEMBL21157291 0.82 EED (0.43) ALDH1A1LMNASMN1; SMN2OPRK1
SCHEMBL21156563 0.82 ALDH1A1 (0.35) ALDH1A1LMNASMN1; SMN2
SCHEMBL23183904 0.81 GSK3B (0.37) ALDH1A1LMNASMN1; SMN2OPRK1
SCHEMBL21113204 0.81 RAB9A (0.42) ALDH1A1LMNASMN1; SMN2

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-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof SHANGHAI HAIHE PHARMACEUTICAL CO., LTD. (CN) 2021-04-06 US disclosed
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF HAIHE BIOPHARMA CO. LTD. (CN) 2019-07-11 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-10968215-B2 Pyrido five-element aromatic ring compound, preparation method therefor and use thereof EZH2, IKZF2, SUZ12 ALDH1A1 2816/4885LMNA 2826/4885SMN1; SMN2 4308/4885
US-20190211010-A1 PYRIDO FIVE-ELEMENT AROMATIC RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF EZH2, IKZF2, SUZ12 ALDH1A1 2816/4885LMNA 2826/4885SMN1; SMN2 4308/4885

“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.