SCHEMBL18153364

SCHEMBL18153364

Cc1ccc(Oc2cc(C)nc(N3CCNCC3)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.58
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 2/20 0.56
CYP2C19 P33261 2/20 0.56
TSHR P16473 2/20 0.56
HTT P42858 1/20 0.56
HSD17B10 Q99714 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP2D6 P10635 1/20 0.54
ATM Q13315 1/20 0.54
SLC6A2 P23975 11/20 0.54
SLC6A3 Q01959 11/20 0.54
SLC6A4 P31645 10/20 0.54
ADRB1 P08588 1/20 0.44
ROCK2 O75116 1/20 0.44
NPC1 O15118 1/20 0.43
MAPT P10636 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
SCHEMBL9014698 0.80 ALDH1A1 (0.49) LMNAMEN1KMT2ACYP1A2TSHR
SCHEMBL21744917 0.77 PLK4 (0.44) LMNAMEN1KMT2ACYP1A2CYP2C9
SCHEMBL1515373 0.77 CASP1 (0.58) MEN1KMT2ACYP1A2CYP2C19TSHR
SCHEMBL18063512 0.76 CASP1 (0.44) LMNAMEN1KMT2ACYP1A2CYP2C9
SCHEMBL23221420 0.76 LMNA (0.50) LMNAMEN1KMT2ACYP1A2CYP2C9
Hydrochloric Acid SCHEMBL8582022 0.76 CASP1 (0.56) MEN1KMT2ACYP1A2CYP2C19TSHR
SCHEMBL18153380 0.75 SMN1; SMN2 (0.53) LMNAMEN1KMT2ACYP1A2CYP2C9
SCHEMBL11395362 0.74 HTR2C (0.64) SMN1; SMN2ALDH1A1ADRB1
SCHEMBL18162559 0.74 KMT2A (0.77) LMNAKMT2ACYP2C9CYP2C19TSHR
SCHEMBL20042166 0.74 SLC6A2 (0.46) LMNAMEN1KMT2ACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3283472-B1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS UNIV INDIANA RES & TECH CORP (US) 2021-04-14 EP disclosed
US-10273228-B2 Hepatitis B viral assembly effectors INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2019-04-30 US disclosed
US-20180099952-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-04-12 US disclosed
US-20180099952-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-04-12 US disclosed
EP-3283472-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS Indiana University Research&Technology Corporation (US) 2018-02-21 EP disclosed
WO-2016168619-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2016-10-20 WO disclosed
WO-2016168619-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2016-10-20 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 (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-20180099952-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS HAVCR2, MAVS, HCCS LMNA 3744/4885MEN1 4380/4885KMT2A 4450/4885
US-10273228-B2 Hepatitis B viral assembly effectors HAVCR2, MAVS, HCCS LMNA 3744/4885MEN1 4380/4885KMT2A 4450/4885

“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.