SCHEMBL7994973

SCHEMBL7994973

ClCN1CCc2ccccc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.70
MEN1 O00255 5/20 0.70
KMT2A Q03164 5/20 0.70
USP2 O75604 1/20 0.70
CDK4 P11802 1/20 0.70
ALOX15 P16050 1/20 0.70
CCND1 P24385 1/20 0.70
MAPT P10636 4/20 0.56
KDM4E B2RXH2 2/20 0.56
LMNA P02545 1/20 0.56
PTK2B Q14289 1/20 0.56
ESR2 Q92731 1/20 0.56
POLB P06746 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
TRPM5 Q9NZQ8 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
MITF O75030 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
SCHEMBL31697960 1.00 ALDH1A1 (0.70) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL30532191 0.84 ALDH1A1 (0.78) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL14059746 0.84 ALDH1A1 (0.78) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL7940135 0.83 ALDH1A1 (1.00) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL12377760 0.83 ALDH1A1 (0.76) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL30672960 0.81 ALDH1A1 (0.72) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL5636449 0.81 ALDH1A1 (0.72) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL29875634 0.80 ALDH1A1 (0.66) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL29558 0.80 ALDH1A1 (0.66) ALDH1A1MEN1KMT2AUSP2CDK4
Hydrochloric Acid SCHEMBL7255401 0.80 ALDH1A1 (0.70) ALDH1A1MEN1KMT2AUSP2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109776378-A Preparation method of polychlorinated methyl indoline without metal catalyst 哈尔滨商业大学 2019-05-21 CN claimed
CN-111995561-B High-yield preparation method of polychloro-methylindoline without metal catalyst 哈尔滨商业大学 2023-07-04 CN disclosed
CN-109776378-A Preparation method of polychlorinated methyl indoline without metal catalyst 哈尔滨商业大学 2019-05-21 CN disclosed
CN-109776378-A Preparation method of polychlorinated methyl indoline without metal catalyst 哈尔滨商业大学 2019-05-21 CN disclosed
CN-109776378-A Preparation method of polychlorinated methyl indoline without metal catalyst 哈尔滨商业大学 2019-05-21 CN disclosed
CN-106831801-B Method for preparing spirooxindole lactone compound by NHC catalysis 南京工业大学 2019-03-15 CN disclosed
US-9969685-B2 Enantioselective synthesis of pyrroloindole compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-15 US disclosed
WO-2018064094-A1 ENANTIOSELECTIVE SYNTHESIS OF PYRROLOINDOLE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-04-05 WO disclosed
US-20180086701-A1 ENANTIOSELECTIVE SYNTHESIS OF PYRROLOINDOLE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2018-03-29 US disclosed
CN-106831801-A Method for preparing spirooxindole lactone compound by NHC catalysis 南京工业大学 2017-06-13 CN disclosed
WO-2001083482-A1 DNA ALKYLATING AGENT AND ACTIVATION THEREOF THE SCRIPPS RESEARCH INSTITUTE (US) 2001-11-08 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 (1 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-20180086701-A1 ENANTIOSELECTIVE SYNTHESIS OF PYRROLOINDOLE COMPOUNDS PCNA, POLR2E, POLL ALDH1A1 2929/4885MEN1 3599/4885KMT2A 2283/4885

“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.