SCHEMBL18540374

SCHEMBL18540374

Cc1cc(C)c(N(c2cccc(-c3ccc([Si](C)(C)C)cn3)c2)c2cccc(-c3ccc([Si](C)(C)C)cn3)c2)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.35
HSD17B1 P14061 3/20 0.33
HSD17B2 P37059 3/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2A6 P11509 1/20 0.33
PSMB5 P28074 1/20 0.31
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31
PIM1 P11309 1/20 0.30
PIM3 Q86V86 1/20 0.30
PIM2 Q9P1W9 1/20 0.30
DHODH Q02127 1/20 0.30
NR1H4 Q96RI1 1/20 0.30
IDO1 P14902 1/20 0.30
METAP2 P50579 1/20 0.30
FYN P06241 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
SCHEMBL18540379 0.87 KDM1A (0.34) KDM1AHSD17B1HSD17B2CYP3A4CYP2A6
SCHEMBL18537473 0.86 GRM5 (0.31)
SCHEMBL18540382 0.84 PSMB5 (0.33) PSMB5NR1H4FYN
SCHEMBL18540375 0.83 CYP11B1 (0.36) KDM1AHSD17B1HSD17B2CYP3A4CYP11B1
SCHEMBL18540383 0.82 HSD17B1 (0.39) KDM1AHSD17B1HSD17B2CYP3A4CYP11B1
SCHEMBL18540377 0.82 PIM1 (0.35) KDM1AHSD17B1HSD17B2CYP2A6PSMB5
SCHEMBL18540387 0.82 CYP2A6 (0.35) CYP2A6PIM1PIM3PIM2
SCHEMBL5102492 0.78 HTR1A (0.42) CYP2A6METAP2
SCHEMBL18540381 0.76 DHFR (0.36) HSD17B1HSD17B2CYP11B1CYP11B2IDO1
SCHEMBL18537313 0.76 KDM1A (0.34) KDM1A

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-20220093880-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2022-03-24 US disclosed
US-11211571-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-12-28 US disclosed
US-20170054095-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD., (KR) 2017-02-23 US disclosed
US-20170054095-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD., (KR) 2017-02-23 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 (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-20220093880-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, LEF1, POU2F1 KDM1A 326/4885HSD17B1 1490/4885HSD17B2 1944/4885
US-11211571-B2 Organometallic compound and organic light-emitting device including the same CRY1, LEF1, POU2F1 KDM1A 326/4885HSD17B1 1490/4885HSD17B2 1944/4885
US-20170054095-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, LEF1, POU2F1 KDM1A 326/4885HSD17B1 1490/4885HSD17B2 1944/4885

“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.