SCHEMBL4419864

SCHEMBL4419864

N#Cc1ccc(OCC2(NC(=O)O)CCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
MMP2 P08253 3/20 0.43
EGLN1 Q9GZT9 3/20 0.43
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MMP3 P08254 4/20 0.41
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MMP13 P45452 1/20 0.41
PTGER4 P35408 1/20 0.40
PTGER2 P43116 1/20 0.40
PTGDR Q13258 1/20 0.40
SCN9A Q15858 1/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL15972528 0.74 SMN1; SMN2 (0.34) LMNAEGLN1MAPTALDH1A1GAA
SCHEMBL15972821 0.73 SMN1; SMN2 (0.36) LMNAEGLN1MAPTALDH1A1KMT2A
SCHEMBL23242478 0.72 LMNA (0.57) LMNAMAPTKMT2AGAAKDM4E
SCHEMBL226222 0.71 HRH3 (0.43) LMNAMAPTALDH1A1MAOBCTSC
SCHEMBL15973448 0.70 CTDSP1 (0.48) LMNAALDH1A1KMT2AKDM4EMEN1
SCHEMBL228937 0.70 ALDH1A1 (0.40) LMNAMMP2MAPTALDH1A1MMP3
SCHEMBL228521 0.69 ALDH1A1 (0.41) LMNAMAPTALDH1A1MAOB
SCHEMBL1608427 0.69 VNN1 (0.42) GAAPOLBRAB9ADPP4
SCHEMBL22769016 0.69 LMNA (0.44) LMNAMMP2MAPTALDH1A1PTGER4
SCHEMBL16468281 0.69 HIF1A (0.46)

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-1577288-B1 Selective estrogen receptor modulators EISAI R&D MAN CO LTD (JP) 2014-07-23 EP disclosed
US-20090325930-A1 SELECTIVE ESTROGEN RECEPTOR MODULATOR RADIUS HEALTH, INC. 2009-12-31 US disclosed
US-7612114-B2 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-11-03 US disclosed
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer EISAI CO., LTD. (JP) 2006-06-01 US disclosed
EP-1577288-A1 SELECTIVE ESTROGEN RECEPTOR MODULATORS Eisai Co., Ltd. (JP) 2005-09-21 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 (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-20090325930-A1 SELECTIVE ESTROGEN RECEPTOR MODULATOR ESR1, GPER1, ESR2 LMNA 3237/4885MMP2 3730/4885EGLN1 1911/4885
US-20060116364-A1 Such as (R)-6-{2-{ethyl[4-(2-ethylaminoethyl)benzyl]amino }-4-methoxyphenyl }-5,6,7,8-tetrahydronaphthalen-2-ol; osteoporosis; breast cancer BRCA1, BCR, RCC1 LMNA 1494/4885MMP2 4259/4885EGLN1 1160/4885

“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.