SCHEMBL22149090

SCHEMBL22149090

CCOC(=O)Nc1cc(OCc2ccccc2)c2cc(OC)c(OC)cc2c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.47
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ELANE P08246 1/20 0.41
KCNQ3 O43525 2/20 0.41
KCNQ2 O43526 2/20 0.41
PPIA P62937 1/20 0.41
DPP4 P27487 1/20 0.41
PSEN1 P49768 2/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
KCNQ4 P56696 1/20 0.41

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
SCHEMBL22148988 0.84 PPIA (0.46) PTPN2PTPN1PTPN6RXRARXRB
SCHEMBL22149137 0.82 PTPN1 (0.46) MGLLPTPN2PTPN1PTPN6RXRA
SCHEMBL22148986 0.82 PTPN1 (0.48) PTPN2PTPN1PTPN6RXRARXRB
SCHEMBL25837396 0.81 PTPN1 (0.49) MGLLPTPN2PTPN1PTPN6RXRA
SCHEMBL25837411 0.80 PTPN1 (0.45) PTPN2PTPN1PTPN6RXRARXRB
SCHEMBL22145142 0.80 ALDH1A1 (0.48) MGLLPTPN1SMN1; SMN2PPIAKDR
SCHEMBL22149016 0.79 PTPN1 (0.43) PTPN2PTPN1PTPN6RXRARXRB
SCHEMBL25837414 0.78 PTPN1 (0.44) MGLLPTPN2PTPN1PTPN6RXRA
SCHEMBL22163295 0.73 SMN1; SMN2 (0.50) SMN1; SMN2NPC1HPGDRAB9AKMT2A
SCHEMBL22163084 0.73 TLR7 (0.49) MGLLPTPN2PTPN1PTPN6RXRA

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-20210317129-A1 Indolenaphthopyrans TRANSITIONS OPTICAL, LTD. (IE) 2021-10-14 US disclosed
WO-2020126030-A1 INDOLENAPHTHOPYRANS AND PHOTOCHROMIC COMPOSITIONS COMPRISING THEM TRANSITIONS OPTICAL, LTD. (IE) 2020-06-25 WO disclosed
WO-2020126029-A1 ARTICLES COMPRISING INDOLENAPHTHOPYRANS TRANSITIONS OPTICAL, LTD. (IE) 2020-06-25 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 (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-20210317129-A1 Indolenaphthopyrans AHR, TDO2, TPH2 MGLL 4400/4885PTPN2 848/4885PTPN1 974/4885

“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.