Sugi Predict

Sugi Predict / Compounds / SCHEMBL21797207

SCHEMBL21797207

SCHEMBL21797207

COc1ccc(C(=C(c2ccccc2)c2ccc(-c3sc(-c4ccc(C(=C(c5ccc(OC)cc5)c5ccc(OC)cc5)c5ccccc5)cc4)c([N+](=O)[O-])c3[N+](=O)[O-])cc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ USP2 O75604 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ CES2 O00748 1/20 0.45
▸ CES1 P23141 1/20 0.45
▸ CNR1 P21554 1/20 0.45
▸ CNR2 P34972 1/20 0.45
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ LMNA P02545 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ RECQL P46063 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ APP P05067 1/20 0.45
▸ ALOX5 P09917 1/20 0.42
▸ PTGS2 P35354 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41

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
SCHEMBL21797203 0.80 MEN1 (0.43) MAPTKMT2AMEN1USP2CYP2C9
SCHEMBL21797216 0.79 MAPT (0.44) MAPTKMT2AMEN1USP2CYP2C9
SCHEMBL21797208 0.79 CES2 (0.47) MAPTKMT2AMEN1CYP2C19CES2
SCHEMBL18872129 0.76 ATM (0.56) MAPTKMT2AMEN1USP2CYP2C9
SCHEMBL20287938 0.76 ALOX5 (0.47) MAPTKMT2AMEN1USP2CYP2C9
SCHEMBL28243502 0.75 CES2 (0.60) MAPTKMT2AMEN1CYP2C19CES2
SCHEMBL68050 0.74 CES2 (0.69) MAPTCYP2C9CYP2C19CES2CES1
SCHEMBL30741457 0.74 CES2 (0.69) MAPTCYP2C9CYP2C19CES2CES1
SCHEMBL68051 0.74 CES2 (0.69) MAPTCYP2C9CYP2C19CES2CES1
SCHEMBL9723456 0.74 CES2 (0.69) MAPTCYP2C9CYP2C19CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12162889-B2 Luminogens for biological applications THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2024-12-10 — — US disclosed
CN-110312708-B Luminescent materials for biological applications 香港科技大学 2023-07-18 — — CN disclosed
US-20220048923-A1 LUMINOGENS FOR BIOLOGICAL APPLICATIONS THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2022-02-17 — — US disclosed
US-11186586-B2 Luminogens for biological applications THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2021-11-30 — — US disclosed
US-20200079787-A1 LUMINOGENS FOR BIOLOGICAL APPLICATIONS THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2020-03-12 — — 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 (4 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-12162889-B2 Luminogens for biological applications BTD, TPD52L2, TTPA MAPT 416/4885KMT2A 4050/4885MEN1 4585/4885
US-20200079787-A1 LUMINOGENS FOR BIOLOGICAL APPLICATIONS BTD, LTA, TPD52L2 MAPT 576/4885KMT2A 3990/4885MEN1 4563/4885
US-20220048923-A1 LUMINOGENS FOR BIOLOGICAL APPLICATIONS BTD, TPD52L2, TTPA MAPT 416/4885KMT2A 4050/4885MEN1 4585/4885
US-11186586-B2 Luminogens for biological applications BTD, LTA, TPD52L2 MAPT 576/4885KMT2A 3990/4885MEN1 4563/4885

“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.