SCHEMBL18118552

SCHEMBL18118552

CC(C)(C)c1ccc2ccc(P(=O)(c3ccccc3)c3ccccc3)cc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 5/20 0.41
▸ LMNA P02545 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ RAB9A P51151 3/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ PLA2G1B P04054 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ATG4B Q9Y4P1 1/20 0.38
▸ KIF11 P52732 1/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.35

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
SCHEMBL17994314 0.95 LMNA (0.41) PTPN1LMNANPSR1RAB9ANPC1
SCHEMBL19735278 0.87 PTPN1 (0.45) PTPN1RAB9ANPC1ALDH1A1PLA2G1B
SCHEMBL11991099 0.84 LMNA (0.47) PTPN1LMNANPSR1RAB9ANPC1
SCHEMBL31212638 0.82 LMNA (0.50) LMNANPSR1RAB9ANPC1ALDH1A1
SCHEMBL17994301 0.82 LMNA (0.50) LMNANPSR1RAB9ANPC1ALDH1A1
SCHEMBL801165 0.81 PPARG (0.38) NPSR1RAB9AMEN1KMT2AKDM4E
SCHEMBL25782641 0.81 NPSR1 (0.47) PTPN1LMNANPSR1RAB9ANPC1
SCHEMBL11916134 0.80 PTPN1 (0.42) PTPN1LMNARAB9ANPC1ALDH1A1
SCHEMBL31212637 0.79 ALDH1A1 (0.47) PTPN1LMNARAB9ANPC1ALDH1A1
SCHEMBL14339277 0.79 ALDH1A1 (0.47) PTPN1LMNARAB9ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9960357-B2 Spiro-type compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2018-05-01 — — US disclosed
US-20170365787-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2017-12-21 — — US disclosed
US-9502669-B2 Organic light emitting diode LG CHEM, LTD. (KR) 2016-11-22 — — US disclosed
US-20160293852-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2016-10-06 — — 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 (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-20170365787-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, NR2E3, LEF1 PTPN1 1699/4885LMNA 3017/4885NPSR1 3336/4885

“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.

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