SCHEMBL5519355

SCHEMBL5519355

CCSc1ncccc1[C]=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
KDM4E B2RXH2 5/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NPC1 O15118 2/20 0.41
HPGD P15428 3/20 0.40
LMNA P02545 2/20 0.40
CLK1 P49759 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.35
GAA P10253 2/20 0.34
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2C9 P11712 1/20 0.34
MAPK1 P28482 1/20 0.34
TP53 P04637 2/20 0.34
SLC22A12 Q96S37 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 2/20 0.33

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
SCHEMBL7710680 0.86 HSD11B1 (0.44) ALDH1A1KDM4ESMN1; SMN2NPC1HPGD
SCHEMBL5203373 0.79 KMT2A (0.41) ALDH1A1KDM4ENPC1HPGDL3MBTL1
SCHEMBL7524889 0.78 CYP1A2 (0.44) ALDH1A1KDM4ESMN1; SMN2HPGDL3MBTL1
SCHEMBL805428 0.76 ALDH1A1 (0.44) ALDH1A1KDM4ESMN1; SMN2NPC1HPGD
SCHEMBL16334247 0.73 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2NPC1HPGD
SCHEMBL10834448 0.73 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2NPC1HPGD
SCHEMBL12048608 0.73 KDM4E (0.45) ALDH1A1KDM4ESMN1; SMN2NPC1HPGD
SCHEMBL12579144 0.73 ALDH1A1 (0.42) ALDH1A1KDM4ESMN1; SMN2NPC1HPGD
SCHEMBL5660651 0.72 ALDH1A1 (0.49) ALDH1A1KDM4ESMN1; SMN2NPC1L3MBTL1
SCHEMBL4257786 0.72 SMN1; SMN2 (0.44) ALDH1A1KDM4ESMN1; SMN2NPC1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241770-B2 Hydronopol derivatives as agonists on human ORL1 receptors SOLVAY PHARMACEUTICALS GMBH (DE) 2007-07-10 US disclosed
US-6951918-B2 Peptidic procollagen C-proteinase inhibitors SYNTEX (U.S.A.) LLC (US) 2005-10-04 US disclosed
US-20050131004-A1 Hydronopol derivatives as agonists on human ORL1 receptors SOLVAY PHARMACEUTICALS GMBH. 2005-06-16 US disclosed
US-6426402-B1 RESPIRATORY SYSTEM DISORDERS; RHEUMATIC DISEASES SYNTEX (U.S.A.) LLC 2002-07-30 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-20050131004-A1 Hydronopol derivatives as agonists on human ORL1 receptors OPRL1, ORMDL3, OGFRL1 ALDH1A1 498/4885KDM4E 4873/4885SMN1; SMN2 2352/4885

“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.