SCHEMBL435010

SCHEMBL435010

Cc1nnn(Cc2ccccc2)c1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.54
GRM2 Q14416 2/20 0.53
TSHR P16473 2/20 0.53
SLC9A1 P19634 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
POLB P06746 3/20 0.50
IDO1 P14902 1/20 0.50
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.47
GAA P10253 2/20 0.46
P2RX7 Q99572 1/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CDC7 O00311 1/20 0.46
PLK4 O00444 1/20 0.46
MAPK13 O15264 1/20 0.46
PDPK1 O15530 1/20 0.46
DAPK3 O43293 1/20 0.46
DYRK3 O43781 1/20 0.46
JAK2 O60674 1/20 0.46

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
SCHEMBL17359159 0.80 IDO1 (0.53) KDM4EGRM2TSHRSLC9A1NPSR1
SCHEMBL28331497 0.80 CYP19A1 (0.58) KDM4EGRM2TSHRSLC9A1POLB
SCHEMBL13844987 0.78 SMN1; SMN2 (0.42) TSHRNPSR1POLBLMNAKMT2A
SCHEMBL15937046 0.78 POLB (0.55) GRM2TSHRSLC9A1POLBIDO1
SCHEMBL795210 0.78 HPGD (0.68) TSHRPOLBKMT2AGAAHPGD
SCHEMBL11948732 0.78 ALDH1A1 (0.58) KDM4EGRM2TSHRSLC9A1NPSR1
SCHEMBL17283083 0.76 PFKFB3 (0.58) TSHRPOLBLMNAKMT2AGAA
SCHEMBL17359178 0.76 HPGD (0.50) GRM2TSHRSLC9A1POLBIDO1
SCHEMBL28713137 0.76 CYP2C19 (0.46) KDM4EGRM2TSHRSLC9A1NPSR1
SCHEMBL15924211 0.75 HPGD (0.60) TSHRPOLBKMT2AGAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968373-A Aromatic heterocyclic compound and preparation method thereof 上海翊石医药科技有限公司 2025-05-09 CN disclosed
WO-2025051214-A1 AROMATIC HETEROCYCLIC COMPOUND AND PREPARATION METHOD THEREFOR 上海翊石医药科技有限公司 2025-03-13 WO disclosed
US-9708335-B2 Spiro-lactam NMDA receptor modulators and uses thereof Apytinyx Inc. (US) 2017-07-18 US disclosed
US-20150368254-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2015-12-24 US disclosed
US-9206173-B2 Heterocyclic compounds for the treatment of stress-related conditions OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-12-08 US disclosed
US-9206173-B2 Heterocyclic compounds for the treatment of stress-related conditions OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-12-08 US disclosed
US-20120065189-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-03-15 US disclosed
US-20120065189-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-03-15 US disclosed
WO-2010137738-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-12-02 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-20150368254-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A KDM4E 2649/4885GRM2 17/4885TSHR 1558/4885
US-20120065189-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS NR3C1, NR3C2, CRH KDM4E 3857/4885GRM2 301/4885TSHR 867/4885

“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.