SCHEMBL3703101

SCHEMBL3703101

CCOC(=O)Cc1c[nH]c2ccc(Br)cc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.67
GABRA1 P14867 1/20 0.60
GABRB1 P18505 1/20 0.60
GABRA3 P34903 1/20 0.60
GABRB2 P47870 1/20 0.60
GPR84 Q9NQS5 1/20 0.55
MTNR1A P48039 1/20 0.54
MTNR1B P49286 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
NR4A2 P43354 1/20 0.50
HTR2A P28223 1/20 0.50
TRPM8 Q7Z2W7 1/20 0.50
JAK2 O60674 1/20 0.49
PAK4 O96013 1/20 0.49
NTRK1 P04629 1/20 0.49

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
SCHEMBL30419995 1.00 PKM (0.67) PKMGABRA1GABRB1GABRA3GABRB2
SCHEMBL4261621 0.89 PKM (0.67) PKMGABRA1GABRB1GABRA3GABRB2
SCHEMBL21808846 0.86 PKM (0.70) PKMMTNR1AMTNR1BSMN1; SMN2MEN1
SCHEMBL2081979 0.86 MTNR1A (0.60) PKMGABRA1GABRB1GABRA3GABRB2
SCHEMBL29444458 0.86 MTNR1A (0.60) PKMGABRA1GABRB1GABRA3GABRB2
SCHEMBL5177499 0.85 PKM (0.68) PKMSMN1; SMN2MEN1ALDH1A1LMNA
SCHEMBL28117217 0.85 CYP1A2 (0.70) PKMGABRA1GABRB1GABRA3GABRB2
SCHEMBL6220526 0.84 PKM (0.67) PKMGABRA1GABRB2SMN1; SMN2MEN1
SCHEMBL21808836 0.84 PKM (0.67) PKMGPR84MTNR1AMTNR1BSMN1; SMN2
SCHEMBL6600034 0.84 PKM (0.67) PKMSMN1; SMN2MEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3636642-B1 INDOLEACETIC ACID DERIVATIVES FOR USE IN THE TREATMENT OF COUGH INST CHINESE MATERIA MEDICA CHINA ACADEMY OF CMS (CN) 2025-12-24 EP disclosed
US-20250066386-A1 INHIBITORS OF KRAS BIOMEA FUSION, INC. 2025-02-27 US disclosed
WO-2023086341-A1 INHIBITORS OF KRAS BIOMEA FUSION, INC. (US) 2023-05-19 WO disclosed
EP-4026828-A1 AUXIN-INDUCIBLE DEGRON SYSTEM KIT AND USE THEREOF Inter-University Research Institute Corporation Research Organization of Information and Systems (JP) 2022-07-13 EP disclosed
US-11008360-B2 Indoleacetic acid derivative and preparation method and pharmaceutical use thereof INSTITUTE OF CHINESE MATERIA MEDICA, CHINA ACADEMY OF CHINESE MEDICAL SCIENCES (CN) 2021-05-18 US disclosed
EP-3636642-A1 INDOLEACETIC ACID DERIVATIVE AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF Institute Of Chinese Materia Medica China Academy of Sciences (CN) 2020-04-15 EP disclosed
US-20200095271-A1 INDOLEACETIC ACID DERIVATIVE AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF INSTITUTE OF CHINESE MATERIA MEDICA, CHINA ACADEMY OF CHINESE MEDICAL SCIENCES (CN) 2020-03-26 US disclosed
WO-2010077882-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed
EP-1581491-A1 INDOLE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-10-05 EP disclosed
EP-1581521-A1 FUSED HETEROCYCLIC DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-10-05 EP disclosed
WO-2004092131-A1 INDOLE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-10-28 WO disclosed
WO-2004063190-A1 FUSED HETEROCYCLIC DERIVATES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-07-29 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 (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-20250066386-A1 INHIBITORS OF KRAS KRAS, NRAS, HRAS PKM 4707/4885GABRA1 3566/4885GABRB1 3413/4885
US-20200095271-A1 INDOLEACETIC ACID DERIVATIVE AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF IDO1, IDO2, TPH1 PKM 1938/4885GABRA1 294/4885GABRB1 573/4885
US-11008360-B2 Indoleacetic acid derivative and preparation method and pharmaceutical use thereof IDO1, IDO2, TPH1 PKM 1938/4885GABRA1 294/4885GABRB1 573/4885

“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.