SCHEMBL18096563

SCHEMBL18096563

Cn1cc(I)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.53
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
LMNA P02545 3/20 0.46
POLB P06746 1/20 0.43
ATM Q13315 1/20 0.43
F2R P25116 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
F2RL3 Q96RI0 1/20 0.42
CYP1A2 P05177 1/20 0.42
KRAS P01116 1/20 0.42
CYP19A1 P11511 1/20 0.41
CDK2 P24941 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTT P42858 1/20 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
SCHEMBL28899170 0.89 MAPT (0.49) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL30095468 0.89 MAPT (0.49) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL20507307 0.81 MAPT (0.56) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL29027035 0.81 MAPT (0.53) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL9400557 0.79 MAPT (0.51) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL30856658 0.78 MAPT (0.50) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL379545 0.78 ALDH1A1 (0.59) MAPTL3MBTL1MEN1KMT2ALMNA
SCHEMBL6488744 0.77 MAPT (0.49) MAPTLMNAPOLBATMCDK2
SCHEMBL5327849 0.77 CDK2 (0.56) MAPTL3MBTL1MEN1KMT2APOLB
SCHEMBL29540778 0.77 MAPT (0.53) MAPTL3MBTL1MEN1KMT2ALMNA

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
WO-2025088534-A1 BICYCLIC HETEROCYCLE COMPOUNDS AS TEAD INHIBITOR DONG-A ST CO., LTD. (KR) 2025-05-01 WO disclosed
US-10385036-B2 Sulfonamide-substituted indole modulators of RORC2 and methods of use thereof PFIZER INC. (US) 2019-08-20 US disclosed
US-20180273504-A1 Sulfonamide-Substituted Indole Modulators of RORC2 and Methods of Use Thereof PFIZER INC. (US) 2018-09-27 US disclosed
WO-2016120850-A9 SULFONAMIDE-SUBSITUTED INDOLE MODULATORS OF RORC2 AND METHODS OF USE THEREOF PFIZER INC. (US) 2017-07-20 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 (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-20180273504-A1 Sulfonamide-Substituted Indole Modulators of RORC2 and Methods of Use Thereof RORC, RORB, RORA MAPT 3810/4885L3MBTL1 4725/4885MEN1 4058/4885
US-10385036-B2 Sulfonamide-substituted indole modulators of RORC2 and methods of use thereof RORC, RORB, RORA MAPT 3939/4885L3MBTL1 4826/4885MEN1 4071/4885

“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.