SCHEMBL19296552

SCHEMBL19296552

c1ccc(-c2c3ccccc3c(-c3ccc(-n4c5ccc6ccccc6c5c5c6ccccc6ccc54)cc3)c3ccc(-c4ccc5ccccc5c4)cc23)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
ESR1 P03372 8/20 0.35
ESR2 Q92731 8/20 0.35
HSD17B1 P14061 2/20 0.35
HSD17B2 P37059 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2B6 P20813 1/20 0.35
CYP2C19 P33261 1/20 0.35
CYP1A1 P04798 3/20 0.33
CYP1B1 Q16678 2/20 0.33
CYP17A1 P05093 1/20 0.33
CYP19A1 P11511 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
NR3C1 P04150 1/20 0.33

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
SCHEMBL19296515 0.99 ESR1 (0.37) PIK3CDPIK3CAMTORESR1ESR2
SCHEMBL19296520 0.97 PIK3CD (0.37) PIK3CDPIK3CAMTORESR1ESR2
SCHEMBL19296548 0.96 ESR1 (0.35) PIK3CDPIK3CAMTORESR1ESR2
SCHEMBL19296535 0.96 ESR1 (0.35) PIK3CDPIK3CAMTORESR1ESR2
SCHEMBL19296517 0.95 ESR1 (0.36) PIK3CDPIK3CAMTORESR1ESR2
SCHEMBL19296525 0.95 PIK3CD (0.35) PIK3CDPIK3CAMTORESR1ESR2
SCHEMBL19296518 0.95 PIK3CD (0.35) PIK3CDPIK3CAMTORESR1ESR2
SCHEMBL23702372 0.95 ESR1 (0.37) ESR1ESR2HSD17B1HSD17B2CYP1A2
SCHEMBL19296431 0.95 ESR1 (0.37) ESR1ESR2HSD17B1HSD17B2CYP1A2
SCHEMBL19296505 0.95 ESR1 (0.37) ESR1ESR2HSD17B1HSD17B2CYP1A2

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-10636976-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2020-04-28 US disclosed
US-20170250346-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-08-31 US disclosed
US-20170250346-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-08-31 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 (2 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-10636976-B2 Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device TTI1, TTI2, TERF2 PIK3CD 4002/4885PIK3CA 4296/4885MTOR 1291/4885
US-20170250346-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE TTI1, TTI2, TERF2 PIK3CD 4002/4885PIK3CA 4296/4885MTOR 1291/4885

“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.