SCHEMBL18552154

SCHEMBL18552154

c1ccc(-c2ccc(-c3ccc4[nH]c(-c5ccc(-c6ccccc6)cc5)c(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.69
ESR2 Q92731 4/20 0.69
PTGS2 P35354 12/20 0.57
MAPK14 Q16539 1/20 0.47
JAK2 O60674 1/20 0.46
NPC1 O15118 1/20 0.46
HTR7 P34969 1/20 0.46
HTR6 P50406 1/20 0.46

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
SCHEMBL18552201 1.00 ESR1 (0.69) ESR1ESR2PTGS2MAPK14JAK2
SCHEMBL12781577 0.91 ESR1 (0.57) ESR1ESR2PTGS2MAPK14HTR7
SCHEMBL12781572 0.91 ESR1 (0.57) ESR1ESR2PTGS2MAPK14HTR7
SCHEMBL13461181 0.86 ESR1 (0.92) ESR1ESR2PTGS2MAPK14HTR6
SCHEMBL22649305 0.86 ESR1 (0.92) ESR1ESR2PTGS2MAPK14HTR6
SCHEMBL18610257 0.84 ESR1 (0.73) ESR1ESR2PTGS2MAPK14
SCHEMBL27902506 0.84 ESR1 (0.67) ESR1ESR2PTGS2MAPK14
SCHEMBL7040942 0.82 PTGS2 (0.72) ESR1ESR2PTGS2MAPK14
SCHEMBL7041577 0.82 ESR1 (0.73) ESR1ESR2PTGS2
SCHEMBL15563263 0.82 PTGS2 (0.72) ESR1ESR2PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11177443-B2 Compound and light emitting diode including same LMS CO., LTD (KR) 2021-11-16 US disclosed
WO-2017030424-A1 NOVEL COMPOUND AND LIGHT EMITTING DIODE INCLUDING SAME 주식회사 엘엠에스 2017-02-23 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-11177443-B2 Compound and light emitting diode including same ARL1, ALDH1A2, DRD1 ESR1 26/4885ESR2 39/4885PTGS2 1976/4885

“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.