SCHEMBL3195817

SCHEMBL3195817

COc1cc2cc[nH]c2cc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.50
▸ TLR7 Q9NYK1 1/20 0.50
▸ MEN1 O00255 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ GPR84 Q9NQS5 1/20 0.43
▸ KIF11 P52732 1/20 0.41
▸ HTR2A P28223 4/20 0.41
▸ HTR2C P28335 3/20 0.41
▸ TUBB4A P04350 1/20 0.40
▸ TUBB P07437 1/20 0.40
▸ TUBA3C P0DPH7 1/20 0.40
▸ TUBA1B P68363 1/20 0.40
▸ TUBA4A P68366 1/20 0.40
▸ TUBB4B P68371 1/20 0.40
▸ TUBB3 Q13509 1/20 0.40
▸ TUBB2A Q13885 1/20 0.40
▸ TUBB8 Q3ZCM7 1/20 0.40
▸ TUBA3E Q6PEY2 1/20 0.40

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
SCHEMBL19431846 0.93 TLR8 (0.47) TLR8TLR7MEN1POLBMAPK1
SCHEMBL28777719 0.80 GPR84 (0.54) MEN1POLBMAPK1KMT2AGPR84
SCHEMBL1748737 0.80 TLR8 (0.60) TLR8TLR7MEN1POLBMAPK1
SCHEMBL30038381 0.79 TLR8 (0.49) TLR8TLR7MEN1POLBMAPK1
SCHEMBL19422763 0.79 TLR8 (0.49) TLR8TLR7MEN1POLBMAPK1
SCHEMBL18239639 0.79 TLR8 (0.49) TLR8TLR7MEN1POLBMAPK1
SCHEMBL296605 0.77 GPR84 (0.62) TLR8TLR7MEN1POLBMAPK1
SCHEMBL3334627 0.77 GPR84 (0.47) MEN1POLBMAPK1KMT2AGPR84
SCHEMBL30403134 0.77 GPR84 (0.62) TLR8TLR7MEN1POLBMAPK1
SCHEMBL8957501 0.76 GPR84 (0.46) MEN1POLBMAPK1KMT2AGPR84

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 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558607-A1 COMPOSITIONS USEFUL AS INHIBITORS OF ROCK AND OTHER PROTEIN KINASES Vertex Pharmaceuticals Incorporated (US) 2005-08-03 — — EP claimed
US-20040122016-A1 Compositions useful as inhibitors of rock and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2004-06-24 — — US claimed
WO-2004041813-A1 COMPOSITIONS USEFUL AS INHIBITORS OF ROCK AND OTHER PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2004-05-21 — — WO claimed
CN-110612284-B Substituted indoline derivatives as dengue virus replication inhibitors 杨森制药公司 2023-10-31 — — CN disclosed
US-11795149-B2 Substituted indoline derivatives as dengue viral replication inhibitors Janssen Pharmaceuticals, Inc. (US) 2023-10-24 — — US disclosed
US-11795149-B2 Substituted indoline derivatives as dengue viral replication inhibitors Janssen Pharmaceuticals, Inc. (US) 2023-10-24 — — US disclosed
CN-110691773-B Substituted indoline derivatives as dengue virus replication inhibitors 杨森制药公司 2023-06-23 — — CN disclosed
CN-110461831-B Substituted indoline derivatives as inhibitors of dengue virus replication 杨森制药公司 2022-11-01 — — CN disclosed
US-20220340522-A1 SUBSTITUTED INDOLINE DERIVATIVES AS DENGUE VIRAL REPLICATION INHIBITORS Janssen Pharmaceuticals, Inc. (US) 2022-10-27 — — US disclosed
EP-3630723-B1 SUBSTITUTED INDOLINE DERIVATIVES AS DENGUE VIRAL REPLICATION INHIBITORS JANSSEN PHARMACEUTICALS INC (US) 2022-08-24 — — EP disclosed
US-11407715-B2 Substituted indoline derivatives as dengue viral replication inhibitors Janssen Pharmaceuticals, Inc. (US) 2022-08-09 — — US disclosed
WO-1998052943-A1 INDOLINE DERIVATIVES AS 5HT2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-11-26 — — WO disclosed
WO-1998004289-A2 PHARMACEUTICAL COMPOSITION CONTAINING A 5HT2C ANTAGONIST AND A D2 ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1998-02-05 — — WO disclosed
WO-1997048699-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-12-24 — — WO disclosed
WO-1997048700-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-12-24 — — WO disclosed
EP-0807104-A2 HETEROCYCLIC COMPOUNDS POSSESSING 5HT 2C? RECEPTOR ANTAGONIST ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1997-11-19 — — EP disclosed
WO-1997008167-A1 5HT2C AND 5HT2B ANTAGONISTS SMITHKLINE BEECHAM P.L.C. (GB) 1997-03-06 — — WO disclosed
WO-1996023783-A1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1996-08-08 — — WO disclosed
WO-1996023769-A2 HETEROCYCLIC COMPOUNDS POSSESSING 5HT2C RECEPTOR ANTAGONIST ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1996-08-08 — — WO disclosed
WO-1996011929-A1 BIHETEROARYL-CARBONYL AND CARBOXAMIDE DERIVATIVES WITH 5HT 2C/2B ANTAGONISTS ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1996-04-25 — — 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 (4 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-11795149-B2 Substituted indoline derivatives as dengue viral replication inhibitors IDO1, INMT, IRF3 TLR8 117/4885TLR7 223/4885MEN1 2037/4885
US-20040122016-A1 Compositions useful as inhibitors of rock and other protein kinases ROCK1, ROCK2, PRKCH TLR8 4835/4885TLR7 4833/4885MEN1 777/4885
US-20220340522-A1 SUBSTITUTED INDOLINE DERIVATIVES AS DENGUE VIRAL REPLICATION INHIBITORS IDO1, INMT, IRF3 TLR8 117/4885TLR7 223/4885MEN1 2037/4885
US-11407715-B2 Substituted indoline derivatives as dengue viral replication inhibitors IDO1, INMT, IRF3 TLR8 117/4885TLR7 223/4885MEN1 2037/4885

“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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