SCHEMBL17478802

SCHEMBL17478802

Cc1cc(O)nc2ccc(NC(=O)c3cc(S(=O)(=O)N4CCOCC4)ccc3F)cc12

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.60
TP53 P04637 4/20 0.59
LMNA P02545 4/20 0.59
MAPT P10636 1/20 0.56
ALDH1A1 P00352 3/20 0.55
NPSR1 Q6W5P4 2/20 0.55
HPGD P15428 1/20 0.55
KMT2A Q03164 1/20 0.54
POLB P06746 1/20 0.54
KDM1A O60341 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MAPK1 P28482 1/20 0.53
CREBBP Q92793 1/20 0.53
HSD17B10 Q99714 1/20 0.53

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
SCHEMBL17479127 0.90 LMNA (0.59) TSHRSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL17478705 0.89 ALDH1A1 (0.63) TSHRSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL17478746 0.87 ALDH1A1 (0.63) TSHRSMN1; SMN2LMNAALDH1A1NPSR1
SCHEMBL17478984 0.87 LMNA (0.57) TSHRSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL17478607 0.85 ALDH1A1 (0.70) SMN1; SMN2LMNAALDH1A1NPSR1HPGD
SCHEMBL17478809 0.84 ALDH1A1 (0.59) SMN1; SMN2LMNAMAPTALDH1A1NPSR1
SCHEMBL17479699 0.83 LMNA (0.53) TSHRSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL17478897 0.82 TSHR (0.49) TSHRSMN1; SMN2TP53LMNAALDH1A1
SCHEMBL17478761 0.82 RAB9A (0.53) SMN1; SMN2TP53LMNAMAPTALDH1A1
SCHEMBL17478700 0.82 LMNA (0.51) TSHRSMN1; SMN2LMNAMAPTALDH1A1

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 TSHR 3378/4885SMN1; SMN2 2459/4885TP53 248/4885
US-10752640-B2 Compounds active towards bromodomains BRD4, BRD3, BRDT TSHR 3378/4885SMN1; SMN2 2459/4885TP53 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.