SCHEMBL4368336

SCHEMBL4368336

CCC(=O)Nc1c(Cl)cccc1[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
LMNA P02545 2/20 0.50
MEN1 O00255 4/20 0.48
ALDH1A1 P00352 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
CYP3A4 P08684 2/20 0.47
NPC1 O15118 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
RAB9A P51151 1/20 0.47
MAPT P10636 5/20 0.45
MAPK1 P28482 1/20 0.45
PKM P14618 1/20 0.45
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL7704551 0.82 MAPT (0.56) L3MBTL1ALDH1A1CYP3A4RAB9AMAPT
SCHEMBL26090787 0.81 MEN1 (0.49) KMT2AL3MBTL1LMNAMEN1ALDH1A1
SCHEMBL8128216 0.79 KMT2A (0.56) KMT2AL3MBTL1LMNAMEN1ALDH1A1
SCHEMBL10224040 0.77 KCNMA1 (0.55) KMT2AL3MBTL1MEN1CYP3A4NPC1
SCHEMBL11103298 0.76 MEN1 (0.51) KMT2ALMNAMEN1ALDH1A1SMN1; SMN2
SCHEMBL14416597 0.76 TSHR (0.61) KMT2AL3MBTL1LMNAMEN1ALDH1A1
SCHEMBL102957 0.76 MAPT (0.49) KMT2AL3MBTL1LMNAMEN1ALDH1A1
SCHEMBL3631214 0.76 MAPT (0.60) KMT2AL3MBTL1MEN1ALDH1A1CYP2C19
SCHEMBL6114931 0.75 KMT2A (0.78) KMT2ALMNAMEN1ALDH1A1NPC1
SCHEMBL21681228 0.75 TSHR (0.54) L3MBTL1LMNAALDH1A1CYP3A4NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1988091-B1 TRICYCLIC COMPOUNDS KYOWA HAKKO KIRIN CO LTD (JP) 2015-06-10 EP disclosed
US-8242151-B2 Tricyclic compounds KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-08-14 US disclosed
CN-101646666-A Tricyclic compounds KYOWA HAKKO KOGYO KK JP 2010-02-10 CN disclosed
US-20090176760-A1 TRICYCLIC COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-07-09 US disclosed
EP-1988091-A1 TRICYCLIC COMPOUNDS Kyowa Hakko Kogyo Co., Ltd (JP) 2008-11-05 EP 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-20090176760-A1 TRICYCLIC COMPOUNDS PPARG, PPARD, PPARA KMT2A 1525/4885L3MBTL1 2446/4885LMNA 2132/4885

“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.