SCHEMBL4491411

SCHEMBL4491411

C=CC(=O)Cc1ccccc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ TSHR P16473 3/20 0.50
▸ LMNA P02545 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ TTR P02766 1/20 0.49
▸ TAAR1 Q96RJ0 1/20 0.49
▸ GAA P10253 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ ATM Q13315 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MTNR1A P48039 1/20 0.47
▸ MTNR1B P49286 1/20 0.47

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
SCHEMBL4423947 0.83 MTNR1A (0.53) KMT2ATSHRLMNASMN1; SMN2TAAR1
SCHEMBL18062275 0.81 L3MBTL1 (0.59) KMT2ATSHRLMNASMN1; SMN2MAPT
SCHEMBL28118170 0.80 ATM (0.58) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL7797890 0.79 VNN1 (0.44) GAA
SCHEMBL29431297 0.78 HSD17B10 (0.61) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL266821 0.78 L3MBTL1 (0.64) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL29737506 0.78 L3MBTL1 (0.64) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL155982 0.78 HSD17B10 (0.61) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL710329 0.78 LMNA (0.56) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL6032361 0.78 L3MBTL1 (0.47) KMT2AMEN1TSHRLMNASMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7566717-B2 Substituted heterocyclic compounds GILEAD SCIENCES, INC. (US) 2009-07-28 — — US disclosed
US-20080275238-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS PALLE VENKATA 2008-11-06 — — US disclosed
US-20070155728-A1 Substituted Heterocyclic Compounds PALLE VENKATA 2007-07-05 — — US disclosed
US-7205303-B2 Substituted heterocyclic compounds CV THERAPEUTICS, INC. (US) 2007-04-17 — — US disclosed
EP-1578737-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS CV THERAPEUTICS, INC. (US) 2005-09-28 — — EP disclosed
US-20040176356-A1 Substituted heterocyclic compounds CV THERAPEUTICS, INC. 2004-09-09 — — US disclosed
WO-2004063180-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS CV THERAPEUTICS, INC. (US) 2004-07-29 — — 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 (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-20040176356-A1 Substituted heterocyclic compounds KCNH1, KCNJ2, SCN5A KMT2A 2698/4885MEN1 4263/4885TSHR 4124/4885
US-20080275238-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS KCNH1, SDHA, COQ8A KMT2A 3029/4885MEN1 2899/4885TSHR 3785/4885
US-20070155728-A1 Substituted Heterocyclic Compounds KCNH1, SDHA, COQ8A KMT2A 3029/4885MEN1 2899/4885TSHR 3785/4885

“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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