SCHEMBL6784145

SCHEMBL6784145

C/C(=C/C(=O)Nc1ccccc1-c1nnn[nH]1)c1ccc2ccccc2c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.61
KDM4E B2RXH2 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 1/20 0.39
LTB4R Q15722 1/20 0.39
ALDH1A1 P00352 3/20 0.37
ALOX12 P18054 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL3279047 0.79 HCAR2 (0.47) KDM4ENPC1RAB9AMAPTLTB4R
SCHEMBL3279060 0.79 HCAR2 (0.47) KDM4ENPC1RAB9AMAPTLTB4R
SCHEMBL29966843 0.76 TERT (1.00) TERTKDM4ENPC1RAB9ALTB4R
SCHEMBL29362821 0.76 TERT (1.00) TERTKDM4ENPC1RAB9ALTB4R
SCHEMBL4022937 0.76 TERT (1.00) TERTKDM4ENPC1RAB9ALTB4R
SCHEMBL16964998 0.76 TERT (1.00) TERTKDM4ENPC1RAB9ALTB4R
SCHEMBL29355750 0.76 TERT (1.00) TERTKDM4ENPC1RAB9ALTB4R
SCHEMBL30760782 0.76 TERT (1.00) TERTKDM4ENPC1RAB9ALTB4R
SCHEMBL6404680 0.76 GPR35 (0.42) KDM4ENPC1RAB9AMAPTALDH1A1
SCHEMBL6408466 0.76 GPR35 (0.47) NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727250-B2 ADMINISTERING COMPOUNDS SUCH AS TRANS-3-(NAPHTH-2-YL)-BUT-2-ENOIC ACID-N-(2-CARBOXY-PHENYL)-AMIDE OR LIKE FOR THERAPY OF CONDITIONS ASSOCIATED WITH INCREASED TELOMERASE ACTIVITY, E.G. TUMOUR DISEASES BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-04-27 US disclosed
US-20020099089-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and preparation BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-07-25 US disclosed
US-6362210-B1 ANTITUMOR, ANTICANCER AGENT BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-03-26 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-20020099089-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and preparation TERT, NAT1, POT1 TERT 1/4885KDM4E 1243/4885NPC1 3387/4885

“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.