SCHEMBL1978102

SCHEMBL1978102

CCOC(=O)C1(CC#N)CC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 5/20 0.37
TSHR P16473 1/20 0.37
ALOX15 P16050 1/20 0.37
POLB P06746 1/20 0.35
OPRM1 P35372 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPK1 P28482 1/20 0.34
OPRD1 P41143 2/20 0.33
OPRK1 P41145 2/20 0.33
LMNA P02545 2/20 0.33
SLC22A1 O15245 1/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
KCNH2 Q12809 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ATM Q13315 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
SCHEMBL16699602 0.93 SMN1; SMN2 (0.39) KMT2AMEN1ALDH1A1TSHRALOX15
SCHEMBL17444067 0.90 MAPK1 (0.33) KMT2AMEN1ALDH1A1TSHRALOX15
SCHEMBL19169756 0.89 KMT2A (0.32) KMT2AMEN1ALDH1A1TSHRSMN1; SMN2
SCHEMBL745218 0.88 OPRM1 (0.46) KMT2AMEN1ALDH1A1TSHRALOX15
SCHEMBL10263 0.87 ALDH1A1 (0.38) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL24515538 0.87 ALDH1A1 (0.34) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL12529117 0.87 KDM4E (0.36) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL17611838 0.84 MAPK1 (0.31) ALDH1A1MAPK1
SCHEMBL22034866 0.82 POLB (0.35) KMT2AMEN1ALDH1A1TSHRPOLB
SCHEMBL25281621 0.80 CYP4F2 (0.44) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11591328-B2 Highly active CSF1R inhibitor compound XIAMEN BIOTIME BIOTECHNOLOGY CO., LTD. (CN) 2023-02-28 US disclosed
US-20200399265-A1 HIGHLY ACTIVE CSF1R INHIBITOR COMPOUND ADLAI NORTYE BIOPHARMA CO., LTD. (CN) 2020-12-24 US disclosed
EP-3744718-A1 HIGHLY ACTIVE CSF1R INHIBITOR COMPOUND Adlai Nortye Biopharma Co., Ltd. (CN) 2020-12-02 EP disclosed
US-9150577-B2 Heterocyclic compounds containing an indole core BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 US disclosed
US-9150577-B2 Heterocyclic compounds containing an indole core BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 US disclosed
US-20130109679-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-02 US disclosed
US-20130109679-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-02 US disclosed
EP-2509980-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE Boehringer Ingelheim International GmbH (DE) 2012-10-17 EP disclosed
WO-2011071716-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-06-16 WO disclosed
WO-2011071716-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-06-16 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-20130109679-A1 HETEROCYCLIC COMPOUNDS CONTAINING AN INDOLE CORE BRSK2, RPS6KA2, RPS6KB2 KMT2A 3498/4885MEN1 3774/4885ALDH1A1 3766/4885
US-11591328-B2 Highly active CSF1R inhibitor compound CSF1R, CSF3R, CD209 KMT2A 469/4885MEN1 492/4885ALDH1A1 2363/4885
US-20200399265-A1 HIGHLY ACTIVE CSF1R INHIBITOR COMPOUND CSF1R, CSF3R, CD209 KMT2A 469/4885MEN1 492/4885ALDH1A1 2363/4885

“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.