SCHEMBL19984584

SCHEMBL19984584

Cc1c[nH]c2cc(C(=O)NCc3cnc(C(F)(F)F)s3)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.47
PDE4B Q07343 1/20 0.47
PDE4C Q08493 1/20 0.47
PDE4D Q08499 1/20 0.47
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TP53 P04637 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
NPC1 O15118 1/20 0.37
KLKB1 P03952 1/20 0.37
MAP4K1 Q92918 1/20 0.37
METAP2 P50579 1/20 0.37
ROCK2 O75116 4/20 0.37
MAPT P10636 1/20 0.36
DDR2 Q16832 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL21273273 0.88 TNKS2 (0.42) RAB9AALDH1A1NPC1ROCK2KDM4E
SCHEMBL19984637 0.82 HTR1D (0.40) RAB9AALDH1A1TRPV1NPC1ROCK2
SCHEMBL19984583 0.79 AR (0.39) RAB9AALDH1A1NPC1ROCK2KDM4E
SCHEMBL19984601 0.78 RAB9A (0.38) RAB9AALDH1A1NPC1ROCK2MAPT
SCHEMBL19984643 0.75 POLB (0.45) RAB9AALDH1A1TP53NPC1MAPT
SCHEMBL19984575 0.74 ABL1 (0.37) RAB9AALDH1A1MAPTKDM4E
SCHEMBL19984571 0.73 POLB (0.35) RAB9A
SCHEMBL21824244 0.69 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DNPC1
SCHEMBL18667786 0.69 ABL1 (0.42) RAB9AALDH1A1TP53MAPT
SCHEMBL18667473 0.69 TP53 (0.53) RAB9AALDH1A1TP53MAPTHPGD

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
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2022-01-27 US disclosed
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2022-01-27 US disclosed
US-10987360-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2021-04-27 US disclosed
US-10987360-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2021-04-27 US disclosed
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2019-08-22 US disclosed
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2019-08-22 US disclosed
WO-2018053157-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES, INC. (US) 2018-03-22 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 (3 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-10987360-B2 Hepatitis B core protein modulators HAVCR2, FABP1, MAVS PDE4A 3133/4885PDE4B 2893/4885PDE4C 3232/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS PDE4A 3133/4885PDE4B 2893/4885PDE4C 3232/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS PDE4A 3133/4885PDE4B 2893/4885PDE4C 3232/4885

“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.