SCHEMBL14850366

SCHEMBL14850366

CCCCOc1cc(Cl)ccc1C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
MAPK1 P28482 3/20 0.50
HTT P42858 2/20 0.50
ALDH1A1 P00352 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
KDM4E B2RXH2 8/20 0.47
GAA P10253 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
HTR2C P28335 3/20 0.42
NPSR1 Q6W5P4 2/20 0.41
GLA P06280 1/20 0.40
RAB9A P51151 1/20 0.39
TSHR P16473 1/20 0.39
HTR2B P41595 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
SCHEMBL14850070 0.85 LMNA (0.49) LMNAMAPK1HTTALDH1A1SMN1; SMN2
SCHEMBL18748269 0.84 TSHR (0.45) LMNAMAPK1HTTALDH1A1SMN1; SMN2
SCHEMBL14850363 0.81 L3MBTL1 (0.61) MAPK1HTTALDH1A1SMN1; SMN2MEN1
SCHEMBL3794601 0.80 L3MBTL1 (0.53) MAPK1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4640550 0.80 LTA4H (0.46) LMNAMAPK1HTTALDH1A1SMN1; SMN2
SCHEMBL19404700 0.80 KDM4E (0.47) LMNAHTTALDH1A1SMN1; SMN2MEN1
SCHEMBL14850360 0.80 AHR (0.43) LMNAHTTALDH1A1SMN1; SMN2KDM4E
SCHEMBL14850369 0.80 L3MBTL1 (0.43) LMNAHTTALDH1A1SMN1; SMN2MEN1
SCHEMBL6232233 0.80 THRA (0.43) LMNAMAPK1HTTALDH1A1SMN1; SMN2
SCHEMBL3785269 0.79 CYP1A2 (0.58) MAPK1HTTALDH1A1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9216979-B2 Antimicrobial compounds and methods of making and using the same MELINTA THERAPEUTICS, INC. (US) 2015-12-22 US disclosed
US-20130090326-A1 Antimicrobial Compounds and Methods of Making and Using the Same RIB-X PHARMACEUTICALS, INC. (US) 2013-04-11 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 (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-20130090326-A1 Antimicrobial Compounds and Methods of Making and Using the Same MPO, LPO, CAT LMNA 2222/4885MAPK1 3970/4885HTT 1768/4885

“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.