SCHEMBL13966262

SCHEMBL13966262

CC(C)Oc1nc2cc(F)ccc2c2cc(F)ccc12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 1/20 0.39
▸ PPM1A P35813 1/20 0.36
▸ MPO P05164 1/20 0.36
▸ ATM Q13315 3/20 0.35
▸ MAPT P10636 3/20 0.35
▸ TSHR P16473 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ BTK Q06187 1/20 0.35
▸ ACHE P22303 2/20 0.34
▸ JAK2 O60674 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ MAPK1 P28482 1/20 0.32
▸ BCHE P06276 3/20 0.32
▸ KCNH2 Q12809 1/20 0.32

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
SCHEMBL13966273 0.91 HTR4 (0.36) HTR4MPOATMMAPTBTK
SCHEMBL13966260 0.91 HTR4 (0.47) HTR4MPOATMMAPTTSHR
SCHEMBL13966261 0.89 MAPT (0.47) HTR4ATMMAPTTSHRL3MBTL1
SCHEMBL13966272 0.89 TRPA1 (0.44) PPM1AATMMAPT
SCHEMBL13966277 0.85 TRPV4 (0.39) PPM1ACYP1A2CYP2C9MAPK1
SCHEMBL13966377 0.85 KIF11 (0.38) HTR4PPM1AMPOATMMAPT
SCHEMBL13966275 0.85 HTR4 (0.36) HTR4MPOATMMAPTBTK
SCHEMBL13966264 0.83 MAPT (0.47) HTR4ATMMAPTTSHRL3MBTL1
SCHEMBL13966266 0.83 MAPT (0.43) ATMMAPT
SCHEMBL13975767 0.81 HTR4 (0.41) HTR4MPOACHECYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8951964-B2 Phenanthridine macrocyclic hepatitis C serine protease inhibitors ABBVIE INC. (US) 2015-02-10 — — US disclosed
US-20120295842-A1 PHENANTHRIDINE MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS ABBVIE INC. 2012-11-22 — — US disclosed
US-20120295842-A1 PHENANTHRIDINE MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS ABBVIE INC. 2012-11-22 — — 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-20120295842-A1 PHENANTHRIDINE MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS TMPRSS15, HPN, PRSS1 HTR4 2316/4885PPM1A 3025/4885MPO 676/4885

“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.

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