SCHEMBL17478761

SCHEMBL17478761

Cc1cc(O)nc2ccc(NC(=O)c3cc(CN4CCOCC4)ccc3F)cc12

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.53
NPC1 O15118 5/20 0.53
TP53 P04637 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
MAPT P10636 6/20 0.50
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 4/20 0.50
HPGD P15428 2/20 0.50
GAA P10253 2/20 0.49
GBA1 P04062 4/20 0.48
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 1/20 0.44
RAD52 P43351 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL17478691 0.87 MAPT (0.49) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL19667039 0.85 MAPT (0.47) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL17478777 0.84 MAPT (0.49) RAB9ANPC1TP53SMN1; SMN2MAPT
SCHEMBL17478811 0.84 GBA1 (0.50) RAB9ANPC1TP53SMN1; SMN2MAPT
SCHEMBL19690659 0.84 GBA1 (0.46) RAB9ANPC1TP53SMN1; SMN2MAPT
SCHEMBL17478679 0.84 MAPT (0.44) RAB9ANPC1TP53SMN1; SMN2MAPT
SCHEMBL17478788 0.83 MAPT (0.45) RAB9ANPC1TP53SMN1; SMN2MAPT
SCHEMBL17478697 0.82 MAPT (0.47) RAB9ANPC1TP53SMN1; SMN2MAPT
SCHEMBL17479223 0.82 GBA1 (0.43) RAB9ANPC1TP53SMN1; SMN2MAPT
SCHEMBL17478802 0.82 TSHR (0.61) TP53SMN1; SMN2MAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106573915-B Compounds active against bromodomains 纽韦卢森公司 2020-12-25 CN disclosed
US-10752640-B2 Compounds active towards bromodomains NUEVOLUTION A/S (DK) 2020-08-25 US disclosed
US-10752640-B2 Compounds active towards bromodomains NUEVOLUTION A/S (DK) 2020-08-25 US disclosed
US-20170349607-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS NUEVOLUTION A/S (DK) 2017-12-07 US disclosed
US-20170349607-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS NUEVOLUTION A/S (DK) 2017-12-07 US disclosed
US-20170349607-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS NUEVOLUTION A/S (DK) 2017-12-07 US disclosed
EP-3174868-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS Nuevolution A/S (DK) 2017-06-07 EP disclosed
WO-2016016316-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS NUEVOLUTION A/S (DK) 2016-02-04 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 (2 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-20170349607-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS BRD4, BRD3, BRDT RAB9A 2450/4885NPC1 1007/4885TP53 248/4885
US-10752640-B2 Compounds active towards bromodomains BRD4, BRD3, BRDT RAB9A 2450/4885NPC1 1007/4885TP53 248/4885

“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.