SCHEMBL2116753

SCHEMBL2116753

COc1nc(Cl)ccc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
MERTK Q12866 1/20 0.39
PDCD1LG2 Q9BQ51 7/20 0.39
CD274 Q9NZQ7 7/20 0.39
CCR4 P51679 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
TDP2 O95551 1/20 0.35
NSD2 O96028 1/20 0.35
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
RRM1 P23921 1/20 0.33
RRM2B Q7LG56 1/20 0.33
APP P05067 1/20 0.33

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
SCHEMBL16234979 0.78 CRHBP (0.41) ALDH1A1GAAHPGDSMN1; SMN2CRHBP
SCHEMBL29364510 0.78 CRHBP (0.41) ALDH1A1GAAHPGDSMN1; SMN2CRHBP
SCHEMBL1191752 0.77 APP (0.35) ALDH1A1PDCD1LG2CD274CCR4MEN1
SCHEMBL19407671 0.77 CRHBP (0.59) ALDH1A1GAAHPGDSMN1; SMN2CRHBP
SCHEMBL30503540 0.77 CRHBP (0.59) ALDH1A1GAAHPGDSMN1; SMN2CRHBP
SCHEMBL15195554 0.76 CRHBP (0.42) ALDH1A1GAAHPGDSMN1; SMN2CRHBP
SCHEMBL2614478 0.76 APOBEC3A (0.40) ALDH1A1HPGDSMN1; SMN2PDCD1LG2CD274
SCHEMBL19002845 0.75 CRHBP (0.38) ALDH1A1GAAHPGDSMN1; SMN2CRHBP
SCHEMBL25246695 0.74 PDCD1LG2 (0.40) PDCD1LG2CD274
SCHEMBL17477974 0.74 CRHBP (0.41) ALDH1A1GAAHPGDSMN1; SMN2CRHBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119371352-A Synthesis method of 6-chloro-3-fluoro-2-methoxypyridine 上海毕臣生化科技有限公司 2025-01-28 CN claimed
EP-4735430-A1 MALT1 INHIBITORS Janssen Pharmaceutica NV (BE) 2026-05-06 EP disclosed
WO-2025076285-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME DELPHIA THERAPEUTICS, INC. (US) 2025-04-10 WO disclosed
CN-119613320-A Synthesis method of compound 3-iodo-1H-indole-2-carboxylic acid 上海毕臣生化科技有限公司 2025-03-14 CN disclosed
CN-119371352-A Synthesis method of 6-chloro-3-fluoro-2-methoxypyridine 上海毕臣生化科技有限公司 2025-01-28 CN disclosed
CN-119371352-A Synthesis method of 6-chloro-3-fluoro-2-methoxypyridine 上海毕臣生化科技有限公司 2025-01-28 CN disclosed
CN-119371352-A Synthesis method of 6-chloro-3-fluoro-2-methoxypyridine 上海毕臣生化科技有限公司 2025-01-28 CN disclosed
WO-2025003414-A1 MALT1 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2025-01-02 WO disclosed
US-20240025898-A1 HPK1 ANTAGONISTS AND USES THEREOF SCHRÖDINGER, INC. 2024-01-25 US disclosed
EP-2626350-B1 CYCLOPROPANE COMPOUND EISAI R&D MAN CO LTD (JP) 2015-04-15 EP disclosed
EP-2626350-B1 CYCLOPROPANE COMPOUND EISAI R&D MAN CO LTD (JP) 2015-04-15 EP disclosed
EP-2626350-A1 CYCLOPROPANE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2013-08-14 EP disclosed
EP-2626350-A1 CYCLOPROPANE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2013-08-14 EP disclosed
US-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 US disclosed
US-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 US disclosed
US-20120095031-A1 CYCLOPROPANE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-19 US disclosed
US-20120095031-A1 CYCLOPROPANE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-19 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 (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-20120095031-A1 CYCLOPROPANE COMPOUND HCRTR1, HCRTR2, CNR1 ALDH1A1 2708/4885GAA 4462/4885HPGD 2630/4885
US-20240025898-A1 HPK1 ANTAGONISTS AND USES THEREOF PDXK, HIPK1, PCK1 ALDH1A1 4740/4885GAA 905/4885HPGD 413/4885

“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.