SCHEMBL10147422

SCHEMBL10147422

CCOC(=O)c1ncc(-c2ccc(C)cc2C)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.41
LMNA P02545 3/20 0.41
KDM4E B2RXH2 3/20 0.41
GAA P10253 3/20 0.41
GLA P06280 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TARBP2 Q15633 1/20 0.39
THRB P10828 1/20 0.39
GABRG2 P18507 3/20 0.38
GABRB3 P28472 3/20 0.38
GABRA5 P31644 3/20 0.38

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
SCHEMBL19814604 0.80 TSHR (0.44) LMNAKDM4EGAAHPGDNPC1
SCHEMBL29775761 0.80 TSHR (0.44) LMNAKDM4EGAAHPGDNPC1
SCHEMBL10147450 0.77 CA1 (0.52) TP53LMNAKDM4EALDH1A1HPGD
SCHEMBL25232953 0.77 KDM4E (0.48) LMNAKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL10147416 0.76 ALDH1A1 (0.53) TP53LMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL30474060 0.75 FAAH (0.57) KDM4EGLAALDH1A1HPGDNPC1
SCHEMBL6833158 0.75 FAAH (0.57) KDM4EGLAALDH1A1HPGDNPC1
SCHEMBL892373 0.75 FAAH (0.52) TP53LMNAKDM4EGAAALDH1A1
SCHEMBL25213509 0.74 ALDH1A1 (0.50) LMNAALDH1A1HPGDSMN1; SMN2L3MBTL1
SCHEMBL5111489 0.74 CDC7 (0.53) TP53KDM4EGAAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993556-B2 Resorcinol derivatives as HSP90 inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-03-31 US disclosed
US-20120046266-A1 RESORCINOL DERIVATIVES AS HSP90 INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-02-23 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-20120046266-A1 RESORCINOL DERIVATIVES AS HSP90 INHIBITORS HSP90AB1, HSP90AA1, HSP90AB2P TP53 94/4885LMNA 3734/4885KDM4E 3420/4885

“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.