SCHEMBL5129388

SCHEMBL5129388

Cc1ccc2c(C(=O)NCCc3ccccc3)c(Cl)ccc2n1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.57
ALDH1A1 P00352 2/20 0.55
ADORA2A P29274 1/20 0.54
ADORA1 P30542 1/20 0.54
LMNA P02545 2/20 0.53
NPC1 O15118 8/20 0.52
RAB9A P51151 8/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
KMT2A Q03164 1/20 0.52
P2RX7 Q99572 1/20 0.47
HIF1A Q16665 1/20 0.47
MAPT P10636 1/20 0.47
USP28 Q96RU2 1/20 0.46
USP25 Q9UHP3 1/20 0.46

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
SCHEMBL5126267 0.79 P2RX7 (0.62) NPC1RAB9ASMN1; SMN2KMT2AP2RX7
SCHEMBL5122075 0.79 P2RX7 (0.62) NPC1RAB9ASMN1; SMN2KMT2AP2RX7
SCHEMBL5128753 0.78 P2RX7 (0.54) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL5121876 0.78 MAPT (0.51) ALDH1A1LMNANPC1RAB9ASMN1; SMN2
SCHEMBL5128732 0.76 HIF1A (0.53) TAAR1NPC1RAB9ASMN1; SMN2P2RX7
SCHEMBL28762492 0.76 NPC1 (0.71) TAAR1ALDH1A1LMNANPC1RAB9A
SCHEMBL3837660 0.74 P2RX7 (0.48) ALDH1A1LMNASMN1; SMN2KMT2AP2RX7
SCHEMBL3837822 0.74 P2RX7 (0.67) NPC1RAB9AKMT2AP2RX7
Hydrochloric Acid SCHEMBL3836582 0.74 P2RX7 (0.66) NPC1RAB9AKMT2AP2RX7
SCHEMBL12571909 0.73 P2RX7 (0.47) ALDH1A1ADORA1LMNASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080058293-A1 Quinoline Derivates and Their Use in Therapy ASTRAZENECA AB (SE) 2008-03-06 US claimed
EP-1651610-A1 QUINOLINE DERIVATES AND THEIR USE IN THERAPY AstraZeneca AB (SE) 2006-05-03 EP claimed
WO-2005009968-A1 QUINOLINE DERIVATES AND THEIR USE IN THERAPY ASTRAZENECA AB (SE) 2005-02-03 WO claimed
US-20080058293-A1 Quinoline Derivates and Their Use in Therapy ASTRAZENECA AB (SE) 2008-03-06 US disclosed
EP-1651610-A1 QUINOLINE DERIVATES AND THEIR USE IN THERAPY AstraZeneca AB (SE) 2006-05-03 EP disclosed
WO-2005009968-A1 QUINOLINE DERIVATES AND THEIR USE IN THERAPY ASTRAZENECA AB (SE) 2005-02-03 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-20080058293-A1 Quinoline Derivates and Their Use in Therapy NQO2, RECQL, CHRM1 TAAR1 883/4885ALDH1A1 985/4885ADORA2A 522/4885

“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.