SCHEMBL404851

SCHEMBL404851

CC(=O)C(O)(c1ccccc1)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 4/20 0.43
PTPN1 P18031 1/20 0.42
PDK1 Q15118 4/20 0.42
PDK2 Q15119 4/20 0.42
PDK3 Q15120 4/20 0.42
PDK4 Q16654 4/20 0.42
TSHR P16473 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 2/20 0.40
ALOX12 P18054 1/20 0.40
HSD11B1 P28845 1/20 0.40
KCNN4 O15554 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
NR1H3 Q13133 3/20 0.39

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
SCHEMBL30450959 0.83 CYP1A2 (0.46) MAPK1NPC1RAB9AALDH1A1PTPN1
SCHEMBL997814 0.83 CYP1A2 (0.46) MAPK1NPC1RAB9AALDH1A1PTPN1
SCHEMBL583285 0.83 CYP1A2 (0.46) MAPK1NPC1RAB9AALDH1A1PTPN1
SCHEMBL9888570 0.83 CYP1A2 (0.46) MAPK1NPC1RAB9AALDH1A1PTPN1
SCHEMBL2398996 0.79 MAPT (0.50) MAPK1NPC1RAB9AALDH1A1PTPN1
SCHEMBL23838114 0.79 MAPK1 (0.47) MAPK1NPC1RAB9AALDH1A1PTPN1
SCHEMBL11205832 0.78 PTPN1 (0.48) RAB9AALDH1A1PTPN1TSHRMAPT
SCHEMBL680607 0.78 CES1 (0.57) MAPK1NPC1RAB9AALDH1A1PTPN1
SCHEMBL20954606 0.75 ALDH1A1 (0.39) MAPK1NPC1RAB9AALDH1A1PDK1
SCHEMBL583794 0.75 CYP1A2 (0.43) MAPK1NPC1RAB9AALDH1A1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260049052-A1 Methods of Synthesizing Chromophore Acceptors LIGHTWAVE LOGIC, INC. (US) 2026-02-19 US claimed
US-20260085190-A1 Chromophores with New Acceptors that Increase Refractive Index LIGHTWAVE LOGIC, INC. (US) 2026-03-26 US disclosed
WO-2026039610-A1 METHODS OF SYNTHESIZING CHROMOPHORE ACCEPTORS LIGHTWAVE LOGIC, INC. (US) 2026-02-19 WO disclosed
US-20260049052-A1 Methods of Synthesizing Chromophore Acceptors LIGHTWAVE LOGIC, INC. (US) 2026-02-19 US disclosed
US-20260049052-A1 Methods of Synthesizing Chromophore Acceptors LIGHTWAVE LOGIC, INC. (US) 2026-02-19 US disclosed
US-8574468-B1 Benzo-fused heterocyclic chromophores for nonlinear optical devices THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2013-11-05 US disclosed
US-8574467-B1 Benzo-fused heterocyclic chromophores for nonlinear optical devices THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2013-11-05 US disclosed
EP-2595975-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX Corning Incorporated (US) 2013-05-29 EP disclosed
US-20120329865-A1 MOLECULES RELATED hERG ION CHANNELS AND THE USE THEREOF CORNING INCORPORATED 2012-12-27 US disclosed
US-20120022116-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX CORNING INCORPORATED 2012-01-26 US disclosed
WO-2012012278-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX CORNING INCORPORATED (US) 2012-01-26 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-20120022116-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX GPR35, GPR65, GPR68 MAPK1 2444/4885NPC1 496/4885RAB9A 2178/4885
US-20260049052-A1 Methods of Synthesizing Chromophore Acceptors PF4, PAH, FGFR4 MAPK1 1366/4885NPC1 1268/4885RAB9A 4279/4885
US-20260085190-A1 Chromophores with New Acceptors that Increase Refractive Index SCO2, HCN1, LBR MAPK1 1247/4885NPC1 909/4885RAB9A 1580/4885
US-20120329865-A1 MOLECULES RELATED hERG ION CHANNELS AND THE USE THEREOF KCNH2, KCNJ2, KCNH3 MAPK1 3183/4885NPC1 278/4885RAB9A 896/4885

“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.