SCHEMBL7078048

SCHEMBL7078048

COc1cc(CC#N)c([N+](=O)[O-])cc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
ALDH1A1 P00352 3/20 0.42
HPGD P15428 1/20 0.42
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
CYP2D6 P10635 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TMEM97 Q5BJF2 3/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
EGFR P00533 1/20 0.36
CHEK1 O14757 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
SCHEMBL8405748 0.84 ALDH1A1 (0.52) ALDH1A1HPGDMAPTHTTCYP2D6
SCHEMBL26601018 0.82 ALDH1A1 (0.45) ALDH1A1HPGDLMNAMAPTHTT
SCHEMBL1197076 0.82 ALDH1A1 (0.45) ALDH1A1HPGDMAPTCYP2D6L3MBTL1
SCHEMBL4373962 0.81 ALDH1A1 (0.46) ALDH1A1HPGDMAPT
SCHEMBL188196 0.81 ALDH1A1 (0.46) ALDH1A1HPGDMAPTCYP2D6L3MBTL1
SCHEMBL4725148 0.80 HTR2A (0.43) HTR2AHTR2CALDH1A1LMNAMAPT
SCHEMBL31275823 0.80 ALDH1A1 (0.45) HTR2AHTR2CALDH1A1HPGDMAPT
SCHEMBL3566138 0.80 AR (0.46) ALDH1A1HPGDLMNAMAPTHTT
SCHEMBL187367 0.79 ALDH1A1 (0.42) ALDH1A1HPGDLMNAMAPTHTT
SCHEMBL6370062 0.78 MAPT (0.47) HTR2AHTR2CALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
EP-3436436-B1 SUBSTITUTED INDOLINE DERIVATIVES AS DENGUE VIRAL REPLICATION INHIBITORS JANSSEN PHARMACEUTICALS INC (US) 2022-05-11 EP disclosed
US-11180450-B2 Substituted indoline derivatives as dengue viral replication inhibitors Janssen Pharmaceuticals, Inc. (US) 2021-11-23 US disclosed
US-11179368-B2 Substituted indoline derivatives as dengue viral replication inhibitors Janssen Pharmaceuticals, Inc. (US) 2021-11-23 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-0808312-A1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1997-11-26 EP 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 (5 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-11180450-B2 Substituted indoline derivatives as dengue viral replication inhibitors IDO1, INMT, IRF3 HTR2A 155/4885HTR2C 187/4885ALDH1A1 3144/4885
US-11795149-B2 Substituted indoline derivatives as dengue viral replication inhibitors IDO1, INMT, IRF3 HTR2A 155/4885HTR2C 187/4885ALDH1A1 3144/4885
US-20220340522-A1 SUBSTITUTED INDOLINE DERIVATIVES AS DENGUE VIRAL REPLICATION INHIBITORS IDO1, INMT, IRF3 HTR2A 155/4885HTR2C 187/4885ALDH1A1 3144/4885
US-11407715-B2 Substituted indoline derivatives as dengue viral replication inhibitors IDO1, INMT, IRF3 HTR2A 155/4885HTR2C 187/4885ALDH1A1 3144/4885
US-11179368-B2 Substituted indoline derivatives as dengue viral replication inhibitors IDO1, INMT, IRF3 HTR2A 155/4885HTR2C 187/4885ALDH1A1 3144/4885

“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.