SCHEMBL6790188

SCHEMBL6790188

COC(=O)c1ccc(NC(=O)c2ccccc2)cc1NC(=O)CC(C)c1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.47
▸ NPC1 O15118 5/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ GAA P10253 1/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ GRIA4 P48058 2/20 0.44
▸ GRIA2 P42262 1/20 0.44
▸ CASP3 P42574 4/20 0.44
▸ SENP7 Q9BQF6 4/20 0.44
▸ SENP8 Q96LD8 3/20 0.44
▸ SENP6 Q9GZR1 3/20 0.44
▸ KDM4E B2RXH2 4/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ PLAU P00749 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ MAPT P10636 4/20 0.42
▸ LMNA P02545 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42

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
SCHEMBL6789605 0.92 RAB9A (0.49) RAB9ANPC1SMN1; SMN2GAAMEN1
SCHEMBL6784822 0.89 TDP1 (0.48) RAB9ASMN1; SMN2GAAMEN1KMT2A
SCHEMBL6784915 0.83 KMT2A (0.57) MEN1KMT2ACASP3SENP7SENP8
SCHEMBL6787909 0.82 RAB9A (0.51) RAB9ANPC1SMN1; SMN2GAAMEN1
SCHEMBL6781577 0.76 KMT2A (0.58) RAB9ANPC1SMN1; SMN2GAAMEN1
SCHEMBL28438951 0.71 RAB9A (0.68) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL14349697 0.71 HCAR2 (0.64) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL2273299 0.71 KDM4E (0.61) RAB9ASMN1; SMN2GAAMEN1KMT2A
SCHEMBL7964170 0.70 RAB9A (0.73) RAB9ANPC1SMN1; SMN2GAAMEN1
SCHEMBL2229842 0.69 NPC1 (0.76) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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 5 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
EP-1261321-A2 CARBOXYLIC ACID AMIDES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND THE USE AND PRODUCTION THEREOF Boehringer Ingelheim Pharma KG (DE) 2002-12-04 — — EP 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
WO-2001007020-A2 CARBOXYLIC ACID AMIDES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND THE USE AND PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-02-01 — — 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-20020099089-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and preparation TERT, NAT1, POT1 RAB9A 2130/4885NPC1 3387/4885SMN1; SMN2 62/4885

“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.

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