SCHEMBL9933671

SCHEMBL9933671

CC1(C)c2cc(C(F)(F)F)ccc2-c2c1cc(O)c1c(Br)cc(Br)cc21

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.31
SRC P12931 1/20 0.31
PRKACA P17612 1/20 0.31
PRKACG P22612 1/20 0.31
PRKACB P22694 1/20 0.31
MEN1 O00255 1/20 0.31
OPRK1 P41145 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
TMPRSS4 Q9NRS4 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL30658606 1.00 TDP2 (0.31) TDP2SRCPRKACAPRKACGPRKACB
SCHEMBL30104207 0.83 ALDH1A1 (0.34) TDP2KMT2ATMPRSS4
SCHEMBL1963833 0.83 ALDH1A1 (0.34) TDP2KMT2ATMPRSS4
SCHEMBL9929735 0.81 ESR1 (0.33) ESR1ESR2
SCHEMBL29664335 0.81 ESR1 (0.33) ESR1ESR2
SCHEMBL1960670 0.75 MEN1 (0.32) MEN1OPRK1HTTKMT2A
SCHEMBL29664191 0.75 MEN1 (0.32) MEN1OPRK1HTTKMT2A
SCHEMBL1815597 0.73 KCNH2 (0.36) MEN1KMT2A
SCHEMBL10323482 0.70 SLC6A2 (0.35) TDP2MEN1KMT2A
SCHEMBL1959954 0.69 PDK2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3621958-B9 PHOTOCHROMIC INDENO FUSED PHENANTHRENOPYRAN COMPOUNDS TRANSITIONS OPTICAL LTD (IE) 2024-09-25 EP disclosed
EP-3621958-B1 PHOTOCHROMIC INDENO FUSED PHENANTHRENOPYRAN COMPOUNDS TRANSITIONS OPTICAL LTD (IE) 2024-07-10 EP disclosed
CN-110730778-B Photochromic indeno-fused phenanthropyran compounds 光学转变有限公司 2023-09-12 CN disclosed
US-11453654-B2 Photochromic indeno fused phenanthrenopyran compounds TRANSITIONS OPTICAL, LTD. (IE) 2022-09-27 US disclosed
EP-3621958-A1 PHOTOCHROMIC INDENO FUSED PHENANTHRENOPYRAN COMPOUNDS Transitions Optical, Ltd. (IE) 2020-03-18 EP disclosed
US-20200048216-A1 Photochromic Indeno Fused Phenanthrenopyran Compounds TRANSITIONS OPTICAL, LTD. (IE) 2020-02-13 US disclosed
CN-110730778-A Photochromic indeno-fused phenanthropyran compounds 光学转变有限公司 2020-01-24 CN disclosed
WO-2018206096-A1 PHOTOCHROMIC INDENO FUSED PHENANTHRENOPYRAN COMPOUNDS TRANSITIONS OPTICAL, LTD. (IE) 2018-11-15 WO disclosed
EP-2651914-B1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2015-05-13 EP disclosed
US-8920928-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2014-12-30 US disclosed
EP-2651914-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS Transitions Optical, Inc. (US) 2013-10-23 EP disclosed
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
WO-2012082999-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 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-20200048216-A1 Photochromic Indeno Fused Phenanthrenopyran Compounds ALDH1A2, RB1, INCENP TDP2 1195/4885SRC 3340/4885PRKACA 4847/4885
US-11453654-B2 Photochromic indeno fused phenanthrenopyran compounds ALDH1A2, RB1, INCENP TDP2 1195/4885SRC 3340/4885PRKACA 4847/4885
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS CRY2, CRY1, IPO4 TDP2 592/4885SRC 2472/4885PRKACA 4464/4885

“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.