SCHEMBL6001175

SCHEMBL6001175

Fc1ccc(-c2nc(N(Cc3ccccc3)C3=COCO3)c3ccccc3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.48
CYP1A2 P05177 6/20 0.45
CYP3A4 P08684 6/20 0.45
CYP2C9 P11712 4/20 0.45
MAPT P10636 4/20 0.45
POLB P06746 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CYP2D6 P10635 5/20 0.43
CYP2C19 P33261 5/20 0.43
LMNA P02545 4/20 0.43
HSD17B10 Q99714 4/20 0.43
USP2 O75604 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
ALOX15 P16050 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ABCG2 Q9UNQ0 2/20 0.40
TSHR P16473 2/20 0.40

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
SCHEMBL6001211 0.83 MAPT (0.40) MAPTPOLBNPSR1HSD17B10USP2
SCHEMBL6001970 0.81 CYP19A1 (0.45) MAPTNPSR1LMNAHSD17B10USP2
SCHEMBL6001383 0.80 ALDH1A1 (0.51) PDE5AMAPTPOLBNPSR1LMNA
Hydrochloric Acid SCHEMBL5369760 0.75 PDE5A (0.36) PDE5ACYP1A2CYP3A4CYP2C9MAPT
SCHEMBL14323090 0.71 PDE5A (0.34) PDE5ACYP1A2CYP3A4CYP2C9MAPT
SCHEMBL4904331 0.71 SMN1; SMN2 (0.41) MAPTPOLBNPSR1LMNAUSP2
SCHEMBL1083856 0.71 CYP2D6 (0.74) PDE5ACYP1A2CYP3A4CYP2C9MAPT
SCHEMBL3450953 0.69 KMT2A (0.41) PDE5ACYP1A2MAPTPOLBCYP2D6
SCHEMBL6001185 0.67 MEN1 (0.37) MAPTNPSR1LMNAHSD17B10MEN1
SCHEMBL3452785 0.67 HSD17B10 (0.45) CYP1A2MAPTNPSR1CYP2C19HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods REDDY US THERAPEUTICS, INC. 2006-06-15 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-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods HPSE, ENGASE, UGCG PDE5A 3180/4885CYP1A2 1500/4885CYP3A4 2894/4885

“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.