SCHEMBL16007231

SCHEMBL16007231

O=C(NCc1ccc(F)cc1)c1cccnc1NC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.55
BACE1 P56817 3/20 0.55
BCHE P06276 2/20 0.54
PRKAA2 P54646 2/20 0.54
SIGMAR1 Q99720 4/20 0.53
SLC6A12 P48065 1/20 0.53
TMEM97 Q5BJF2 1/20 0.53
MCHR1 Q99705 1/20 0.53
KMT2A Q03164 3/20 0.53
SSTR5 P35346 1/20 0.52
ALDH1A1 P00352 2/20 0.52
DRD4 P21917 1/20 0.51
MEN1 O00255 1/20 0.49
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
ATM Q13315 1/20 0.48
GPR55 Q9Y2T6 1/20 0.48

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
SCHEMBL16017733 0.94 DRD4 (0.57) ACHESIGMAR1KMT2ADRD4MEN1
SCHEMBL16007644 0.90 SIGMAR1 (0.55) SIGMAR1KMT2ADRD4MEN1
SCHEMBL16007559 0.85 KDM4E (0.54) ACHEBACE1BCHEPRKAA2SIGMAR1
SCHEMBL16007213 0.83 SIGMAR1 (0.57) ACHESIGMAR1KMT2ADRD4MEN1
SCHEMBL16007643 0.82 POLB (0.52) SIGMAR1SLC6A12MCHR1KMT2ADRD4
SCHEMBL16007613 0.82 SIGMAR1 (0.56) ACHESIGMAR1KMT2ADRD4MEN1
SCHEMBL16007664 0.80 POLB (0.59) SIGMAR1KMT2AALDH1A1DRD4MEN1
SCHEMBL16017724 0.80 ALDH1A1 (0.52) ALDH1A1
SCHEMBL16017732 0.80 KMT2A (0.52) SIGMAR1SLC6A12KMT2ADRD4MEN1
SCHEMBL16007371 0.78 SIGMAR1 (0.54) PRKAA2SIGMAR1SLC6A12MCHR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 US claimed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 US claimed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 US disclosed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 US disclosed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 US disclosed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 US disclosed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 US disclosed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 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-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same VEGFA, EDF1, FLT1 ACHE 4312/4885BACE1 3476/4885BCHE 4543/4885

“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.