SCHEMBL16747724

SCHEMBL16747724

Cc1ccc2cc(=O)[nH]c(C)c2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.72
▸ ALDH1A1 P00352 5/20 0.63
▸ CA12 O43570 1/20 0.48
▸ CA9 Q16790 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ CYP1A2 P05177 5/20 0.46
▸ TYMS P04818 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ PDE3B Q13370 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ CYP2A6 P11509 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ DAO P14920 1/20 0.41
▸ DDO Q99489 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 2/20 0.39
▸ PKM P14618 1/20 0.39

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
SCHEMBL16740896 0.78 ALDH1A1 (1.00) LMNAALDH1A1KDM4ECYP1A2SMN1; SMN2
Hydrochloric Acid SCHEMBL16740892 0.76 ALDH1A1 (0.96) LMNAALDH1A1KDM4ECYP1A2SMN1; SMN2
SCHEMBL824649 0.72 KDM4E (0.63) LMNAALDH1A1CA12CA9KDM4E
SCHEMBL31475465 0.69 LMNA (0.67) LMNAALDH1A1CA12CA9KDM4E
SCHEMBL9724162 0.69 LMNA (0.67) LMNAALDH1A1CA12CA9KDM4E
SCHEMBL1719929 0.69 TYMS (0.50) LMNAALDH1A1CA12CA9KDM4E
SCHEMBL6646013 0.69 SAE1 (0.46) LMNAALDH1A1CA12CA9KDM4E
SCHEMBL7440342 0.69 PDE3B (0.73) LMNAALDH1A1KDM4ESMN1; SMN2PDE3B
SCHEMBL10028805 0.69 CYP2A6 (0.54) LMNAALDH1A1CA12CA9KDM4E
SCHEMBL8404577 0.68 CYP1A2 (0.46) LMNAALDH1A1CA12CA9KDM4E

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-9738630-B2 Inhibitors of lysine methyl transferase BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-22 — — US disclosed
US-20160297806-A1 INHIBITORS OF LYSINE METHYL TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2016-10-13 — — US disclosed
WO-2015077193-A1 INHIBITORS OF LYSINE METHYL TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 2015-05-28 — — 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-20160297806-A1 INHIBITORS OF LYSINE METHYL TRANSFERASE EZH2, DOT1L, EHMT1 LMNA 3571/4885ALDH1A1 2301/4885CA12 3996/4885

“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.

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