SCHEMBL3342262

SCHEMBL3342262

Cc1cc2c(cc1N)NC(=O)CO2

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.57
PDE3B Q13370 1/20 0.53
PDE3A Q14432 1/20 0.53
TP53 P04637 3/20 0.50
THRB P10828 2/20 0.50
MAPT P10636 2/20 0.50
ALDH1A1 P00352 2/20 0.49
HTT P42858 1/20 0.49
PARP1 P09874 1/20 0.49
PKM P14618 6/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
LMNA P02545 2/20 0.44
HPGD P15428 1/20 0.44
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 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
SCHEMBL8303156 0.93 MMP12 (0.57) MMP12PDE3BPDE3ATP53THRB
SCHEMBL2953764 0.86 MMP12 (0.64) MMP12PDE3BPDE3ATP53THRB
SCHEMBL3342717 0.83 MMP12 (0.49) MMP12PDE3BPDE3ATP53THRB
SCHEMBL305188 0.83 MMP12 (0.57) MMP12PDE3BPDE3ATP53THRB
SCHEMBL3344322 0.81 PARP1 (0.57) MMP12TP53THRBMAPTALDH1A1
SCHEMBL30638088 0.80 MMP12 (0.49) MMP12TP53THRBMAPTALDH1A1
SCHEMBL7868455 0.80 MMP12 (0.49) MMP12TP53THRBMAPTALDH1A1
SCHEMBL1853066 0.80 MMP12 (0.57) MMP12PDE3BPDE3ATP53THRB
SCHEMBL8303159 0.80 MMP12 (0.49) MMP12PDE3BPDE3ATP53THRB
SCHEMBL13652221 0.78 MMP12 (0.54) MMP12PDE3BPDE3ATP53THRB

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-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US claimed
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
US-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 US disclosed
EP-0548254-B1 6- OR 7-(IMIDAZOLIDIN-2-YLIDENEAMINO)-1,4-BENZOXAZINES AS ALPHA ADRENERGIC AGENTS ALLERGAN INC (US) 1999-06-02 EP disclosed
EP-0548254-A1 6- or 7- (2-IMINO-2-IMIDAZOLIDINE)-1,4-BENZOXAZINES AS ALPHA ADRENERGIC AGENTS ALLERGAN, INC. (US) 1993-06-30 EP disclosed
WO-1992004345-A1 6- or 7- (2-IMINO-2-IMIDAZOLIDINE)-1,4-BENZOXAZINES AS ALPHA ADRENERGIC AGENTS ALLERGAN, INC. (US) 1992-03-19 WO disclosed
US-5091528-A Antiglaucoma, antidiarrhea agents, diuretics, vasoconstrictors ALLERGAN, INC. (US) 1992-02-25 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 (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-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX3, P2RX1 MMP12 3146/4885PDE3B 1272/4885PDE3A 1353/4885

“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.