SCHEMBL91992

SCHEMBL91992

Cc1ccc(-c2ccc(-c3ccc(C#N)cc3)cc2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
CYP2A6 P11509 1/20 0.53
KIF11 P52732 3/20 0.53
PDE3B Q13370 2/20 0.47
PDE3A Q14432 2/20 0.47
AR P10275 1/20 0.44
KDM1A O60341 6/20 0.43
MAPKAPK2 P49137 1/20 0.42
CYP11B2 P19099 3/20 0.41
CYP11B1 P15538 2/20 0.41
PDK2 Q15119 1/20 0.40
MMP3 P08254 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
SCHEMBL91862 1.00 ALDH1A1 (0.53) ALDH1A1CYP2A6KIF11PDE3BPDE3A
SCHEMBL19608729 0.92 ALDH1A1 (0.50) ALDH1A1CYP2A6KIF11PDE3BPDE3A
SCHEMBL397141 0.91 KIF11 (0.61) KIF11PDE3BPDE3ACYP11B2CYP11B1
SCHEMBL91880 0.90 ALDH1A1 (0.52) ALDH1A1CYP2A6KIF11PDE3BPDE3A
SCHEMBL28428605 0.90 ALDH1A1 (0.52) ALDH1A1CYP2A6KIF11PDE3BPDE3A
SCHEMBL16945886 0.86 AR (0.48) ALDH1A1CYP2A6KIF11PDE3BPDE3A
SCHEMBL170435 0.86 PDE3B (0.49) PDE3BPDE3AARPDK2
SCHEMBL16945958 0.85 KIF11 (0.47) ALDH1A1CYP2A6KIF11PDE3BPDE3A
SCHEMBL19308493 0.85 KIF11 (0.54) KIF11PDE3BPDE3ACYP11B2CYP11B1
SCHEMBL15834358 0.85 KIF11 (0.54) KIF11PDE3BPDE3AKDM1ACYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11667840-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2023-06-06 US disclosed
US-11208594-B2 Liquid-crystalline medium and high-frequency components comprising same MERCK PATENT GMBH (DE) 2021-12-28 US disclosed
US-10975308-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2021-04-13 US disclosed
EP-3529331-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-10-07 EP disclosed
US-10676670-B2 Liquid-crystalline medium and high-frequency components comprising same MERCK PATENT GMBH (DE) 2020-06-09 US disclosed
US-10662377-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2020-05-26 US disclosed
EP-3504293-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-05-13 EP disclosed
EP-3433337-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-04-29 EP disclosed
US-10550326-B2 Liquid-crystalline medium and high-frequency components comprising same MERCK PATENT GMBH (DE) 2020-02-04 US disclosed
EP-3140369-B1 LIQUID-CRYSTALLINE MEDIUM AND HIGH-FREQUENCY COMPONENTS COMPRISING SAME MERCK PATENT GMBH (DE) 2019-10-23 EP disclosed
US-20090267025-A1 LIQUID CRYSTAL SYSTEM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2009-10-29 US disclosed
US-20090247620-A1 Benzochromene Derivatives for Use in Liquid Crystal Media and as Therapeutic Active Substances MERCK PATENT GMBH (DE) 2009-10-01 US disclosed
US-7531106-B2 Mesogenic compounds, medium for electro-optical displays and electro-optical display MERCK PATENT GMBH (DE) 2009-05-12 US disclosed
US-20090023802-A1 Benzochromene Derivatives MERCK PATENT GMBH (DE) 2009-01-22 US disclosed
US-7440160-B2 Electro-optical light modulating element, electro-optical display and modulating medium MERCK PATENT GMBH (DE) 2008-10-21 US disclosed
US-20080177095-A1 FUROCHROMAN DERIVATIVES MERCK PATENT GMBH (DE) 2008-07-24 US disclosed
US-20080167482-A1 mesogenic group is linked to the C-atom No. 5 of the 1,3-dioxane-5-yl group; media showing a blue phase and their use in electro-optical light modulation elements MERCK PATENT GMBH (DE) 2008-07-10 US disclosed
US-20080116419-A1 Mesogenic Compounds, Liquid Crystal Medium and Liquid Crystal Display MERCK PATENT GMBH (DE) 2008-05-22 US disclosed
US-7361288-B2 Components for high-frequency technology MERCK PATENT GESELLSCHAFT MIT BESSCHRANKTER HAFTUNG (DE) 2008-04-22 US disclosed
US-7326447-B2 Benzochromene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-02-05 US 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-20080177095-A1 FUROCHROMAN DERIVATIVES CFD, LMAN1, UROD ALDH1A1 1075/4885CYP2A6 2847/4885KIF11 2305/4885
US-20090247620-A1 Benzochromene Derivatives for Use in Liquid Crystal Media and as Therapeutic Active Substances LPO, SBDS, OCIAD1 ALDH1A1 1625/4885CYP2A6 1448/4885KIF11 3176/4885
US-20090023802-A1 Benzochromene Derivatives SBDS, CRY1, DDT ALDH1A1 676/4885CYP2A6 269/4885KIF11 4044/4885
US-20080116419-A1 Mesogenic Compounds, Liquid Crystal Medium and Liquid Crystal Display CRY1, CRY2, IK ALDH1A1 2978/4885CYP2A6 2777/4885KIF11 330/4885
US-11667840-B2 Liquid-crystalline medium FES, BLM, CXCL12 ALDH1A1 3893/4885CYP2A6 3564/4885KIF11 954/4885

“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.