SCHEMBL4372939

SCHEMBL4372939

CCCC(=O)Oc1cccc(C(CC)(NC(=O)OCc2ccccc2)C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CXCR2 P25025 1/20 0.38
PRTN3 P24158 1/20 0.37
MGLL Q99685 2/20 0.37
FAAH O00519 1/20 0.36
CACNA1B Q00975 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL4383644 0.82 MEN1 (0.45) MEN1KMT2ANPC1RAB9ACXCR2
SCHEMBL5711399 0.82 MEN1 (0.51) MEN1KMT2ANPC1RAB9ACXCR2
SCHEMBL27830337 0.77 MGLL (0.60) ATMNPC1RAB9AMGLLFAAH
SCHEMBL4372592 0.73 KMT2A (0.46) MEN1KMT2AFAAH
SCHEMBL27633327 0.72 MAOB (0.57) MEN1KMT2A
SCHEMBL20815710 0.72 ALDH1A1 (0.43) KMT2ACACNA1BMAPT
SCHEMBL9830821 0.71 LMNA (0.45) MEN1KMT2ANPC1RAB9ACXCR2
SCHEMBL9830815 0.71 LMNA (0.45) MEN1KMT2ANPC1RAB9ACXCR2
SCHEMBL27574117 0.71 MAPT (0.58) MEN1KMT2ANPC1RAB9AMGLL
SCHEMBL9828915 0.71 KDM4E (0.51) ATMMEN1KMT2ANPC1RAB9A

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
EP-1390343-B1 NOVEL RETINOID DERIVATIVES AND AN ANTI-CANCER PHARMACEUTICAL COMPOSITION COMPRISING SAID COMPOUNDS CHEBIGEN CO LTD (KR) 2009-10-14 EP disclosed
US-7166744-B2 Retinoid derivatives and methods for producing said compounds and anti-cancer pharmaceutical composition comprising said compounds CHEBIGEN CO., LTD. (KR) 2007-01-23 US disclosed
EP-1390343-A4 NOVEL RETINOID DERIVATIVES AND METHODS FOR PRODUCING SAID COMPOUNDS AND AN ANTI-CANCER PHARMACEUTICAL COMPOSITION COMPRISING SAID COMPOUNDS CHEBIGEN CO LTD (KR) 2005-06-22 EP disclosed
EP-1390343-A1 NOVEL RETINOID DERIVATIVES AND METHODS FOR PRODUCING SAID COMPOUNDS AND AN ANTI-CANCER PHARMACEUTICAL COMPOSITION COMPRISING SAID COMPOUNDS Chebigen Co., Ltd. (KR) 2004-02-25 EP disclosed
US-20030171339-A1 Novel retinoid derivatives and methods for producing said compounds and anti-cancer pharmaceutical composition comprising said compounds CHEBIGEN CO., LTD. (KR) 2003-09-11 US disclosed
WO-2002096857-A1 NOVEL RETINOID DERIVATIVES AND METHODS FOR PRODUCING SAID COMPOUNDS AND AN ANTI-CANCER PHARMACEUTICAL COMPOSITION COMPRISING SAID COMPOUNDS CHEBIGEN CO., LTD. (KR) 2002-12-05 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-20030171339-A1 Novel retinoid derivatives and methods for producing said compounds and anti-cancer pharmaceutical composition comprising said compounds RXRB, RARB, RXRA ATM 3636/4885MEN1 2083/4885KMT2A 3305/4885

“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.