SCHEMBL5773712

SCHEMBL5773712

Cc1nccn1Cc1cccc2c1CCNC2

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CD44 P16070 2/20 0.41
▸ KCNH2 Q12809 5/20 0.36
▸ LMNA P02545 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ P2RX7 Q99572 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ PNMT P11086 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL7107413 0.73 MC4R (0.37) KCNH2MEN1KMT2A
SCHEMBL29900980 0.73 LMNA (0.51) KCNH2LMNAL3MBTL1P2RX7MEN1
SCHEMBL12653659 0.72 LMNA (0.45) KCNH2LMNAL3MBTL1MEN1KMT2A
SCHEMBL12942082 0.72 CD44 (0.56) CD44PNMTMAOB
SCHEMBL14012985 0.69 CD44 (0.53) CD44PNMTMAOB
SCHEMBL14355970 0.69 HTR1A (0.49) —
SCHEMBL330124 0.69 CD44 (0.56) CD44PNMTMAOB
SCHEMBL30613500 0.69 ADRA2C (0.58) LMNAL3MBTL1P2RX7MEN1KMT2A
SCHEMBL5776703 0.69 P2RX3 (0.46) —
SCHEMBL21744609 0.69 CYP2A13 (0.48) CD44MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 — — EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 — — US disclosed
EP-1483257-A1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY Pfizer Limited (GB) 2004-12-08 — — EP disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 — — US disclosed
WO-2003076427-A1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LIMITED (GB) 2003-09-18 — — 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-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 CD44 4761/4885KCNH2 424/4885LMNA 945/4885

“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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