SCHEMBL6449313

SCHEMBL6449313

Cc1nc2cc(-c3ccc(/C=C4\SC(=O)NC4=O)cn3)cc(OCc3ccccc3)c2o1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 11/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
HPGD P15428 5/20 0.52
POLB P06746 2/20 0.50
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TTR P02766 1/20 0.48
BLM P54132 1/20 0.48
PLA2G1B P04054 1/20 0.48
HTT P42858 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
ADAMTS5 Q9UNA0 1/20 0.45

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
SCHEMBL6449316 1.00 PTPN1 (0.53) PTPN1MEN1KMT2AHPGDPOLB
SCHEMBL6449309 0.85 PTPN1 (0.55) PTPN1MEN1KMT2AHPGDPOLB
SCHEMBL6449311 0.85 PTPN1 (0.55) PTPN1MEN1KMT2AHPGDPOLB
SCHEMBL6447855 0.79 PTPN1 (0.60) PTPN1MEN1KMT2AHPGDPOLB
SCHEMBL6447851 0.79 PTPN1 (0.60) PTPN1MEN1KMT2AHPGDPOLB
SCHEMBL6450518 0.79 NPC1 (0.41) HPGDMAOAMAOBKDM4EHTT
SCHEMBL6450520 0.79 NPC1 (0.41) HPGDMAOAMAOBKDM4EHTT
SCHEMBL6457211 0.79 HPGD (0.44) HPGDHTT
SCHEMBL6450393 0.78 PTPN1 (0.57) PTPN1MEN1KMT2AHPGDPOLB
SCHEMBL6450388 0.78 PTPN1 (0.57) PTPN1MEN1KMT2AHPGDPOLB

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-20050014767-A1 Benzoxazole, benzothiazole, and benzimidazole derivatives for the treatment of cancer and other diseases INCYTE CORPORATION 2005-01-20 US claimed
US-20050014767-A1 Benzoxazole, benzothiazole, and benzimidazole derivatives for the treatment of cancer and other diseases INCYTE CORPORATION 2005-01-20 US disclosed
WO-2004066952-A2 BENZOXAZOLE, BENZOTHIAZOLE, AND BENZIMIDAZOLE DERIVATIVES FOR THE TREATMENT OF CANCER AND OTHER DISEASES INCYTE CORPORATION (US) 2004-08-12 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-20050014767-A1 Benzoxazole, benzothiazole, and benzimidazole derivatives for the treatment of cancer and other diseases AR, CCNT1, BRD1 PTPN1 3762/4885MEN1 3126/4885KMT2A 1609/4885

“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.