SCHEMBL4230193

SCHEMBL4230193

O=C1c2ccc(O)c(O)c2C(=O)N1Cc1c(F)ccc(F)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ MAPT P10636 4/20 0.36
▸ RECQL P46063 3/20 0.36
▸ USP2 O75604 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ RGS12 O14924 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ MAPK1 P28482 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.34
▸ ALOX15 P16050 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ MAOA P21397 2/20 0.34
▸ APEX1 P27695 2/20 0.34
▸ RAF1 P04049 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ THRB P10828 1/20 0.34

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
SCHEMBL4231517 0.88 MAPT (0.35) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4368938 0.86 CA12 (0.42) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4368983 0.86 CA12 (0.47) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4367878 0.82 GRM5 (0.43) MEN1KMT2AMAPTUSP2HTT
SCHEMBL4372311 0.81 PIK3CA (0.48) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4374700 0.79 CASP3 (0.52) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4370400 0.78 HDAC4 (0.42) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4369470 0.78 P2RX7 (0.35) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4224823 0.78 MEN1 (0.36) MEN1KMT2AMAPTRECQLUSP2
SCHEMBL4220045 0.78 MEN1 (0.41) MEN1KMT2AMAPTRECQLUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009026248-A2 HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) 2009-02-26 — — WO claimed
US-20090062322-A1 Novel Tricyclic Spiropiperidines or Spiropyrrolidines ASTRAZENECA AB (SE) 2009-03-05 — — US disclosed
WO-2009026248-A2 HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) 2009-02-26 — — WO disclosed
WO-2009026248-A2 HYDRAZIDE, AMIDE, PHTHALIMIDE AND PHTHALHYDRAZIDE ANALOGS AS INHIBITORS OF RETROVIRAL INTEGRASE THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, OFFICE OF TECHNOLOGY TRANSFER (US) 2009-02-26 — — WO disclosed
US-7449475-B2 Tricyclic spiropiperidines or spiropyrrolidines ASTRAZENECA AB (SE) 2008-11-11 — — US disclosed
US-20050245741-A1 Novel tricyclic spiropiperidines or spiropyrrolidines ASTRAZENECA AB (SE) 2005-11-03 — — 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 (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-20090062322-A1 Novel Tricyclic Spiropiperidines or Spiropyrrolidines REN, TACR1, AGTR1 MEN1 642/4885KMT2A 2480/4885MAPT 4171/4885
US-20050245741-A1 Novel tricyclic spiropiperidines or spiropyrrolidines REN, TACR1, AGTR1 MEN1 809/4885KMT2A 2648/4885MAPT 4115/4885

“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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