SCHEMBL7216257

SCHEMBL7216257

Clc1ncnc2sc3ccccc3c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.44
▸ PDE4B Q07343 1/20 0.44
▸ PDE4C Q08493 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ LIMK1 P53667 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ CDK5R1 Q15078 1/20 0.40
▸ GPR3 P46089 1/20 0.40
▸ ADORA3 P0DMS8 2/20 0.39
▸ ADORA2A P29274 2/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ MAPT P10636 4/20 0.38
▸ HTT P42858 2/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ LOXL2 Q9Y4K0 1/20 0.37
▸ SELE P16581 1/20 0.37
▸ VCAM1 P19320 1/20 0.37
▸ LMNA P02545 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ ADK P55263 1/20 0.36

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
SCHEMBL924654 0.79 LIMK1 (0.56) LIMK1CDK5CDK5R1GPR3MAPT
SCHEMBL17109971 0.79 LIMK1 (0.40) LIMK1CDK5CDK5R1GPR3MAPT
SCHEMBL12903904 0.79 LIMK1 (0.40) LIMK1CDK5CDK5R1GPR3SMN1; SMN2
SCHEMBL2313439 0.77 SMN1; SMN2 (0.46) ADORA3ADORA2ASMN1; SMN2MAPTHTT
SCHEMBL18370866 0.76 ADORA2A (0.47) LIMK1CDK5CDK5R1GPR3ADORA2A
SCHEMBL24057409 0.75 AURKA (0.41) LIMK1CDK5CDK5R1GPR3SMN1; SMN2
SCHEMBL17287232 0.75 ELANE (0.41) GPR3SMN1; SMN2MAPTKMT2ALOXL2
SCHEMBL21164751 0.75 MRGPRX1 (0.37) LIMK1CDK5CDK5R1GPR3MAPT
SCHEMBL19118255 0.74 ELANE (0.43) GPR3SMN1; SMN2MAPTLOXL2LMNA
SCHEMBL16693475 0.74 LOXL2 (0.43) GPR3SMN1; SMN2MAPTHTTKMT2A

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172057-A1 HETEROCYCLIC COMPOUND CONTAINING HETEROATOM SUBSTITUTED FLUORENE AND OPTOELECTRONIC DEVICE WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2023-06-01 — — US disclosed
US-20230172057-A1 HETEROCYCLIC COMPOUND CONTAINING HETEROATOM SUBSTITUTED FLUORENE AND OPTOELECTRONIC DEVICE WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2023-06-01 — — US disclosed
US-9790234-B2 IRAK inhibitors and uses thereof NIMBUS IRIS, INC. (US) 2017-10-17 — — US disclosed
US-9790234-B2 IRAK inhibitors and uses thereof NIMBUS IRIS, INC. (US) 2017-10-17 — — US disclosed
US-9790234-B2 IRAK inhibitors and uses thereof NIMBUS IRIS, INC. (US) 2017-10-17 — — US disclosed
US-20170081340-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS INC (US) 2017-03-23 — — US disclosed
US-20170081340-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS INC (US) 2017-03-23 — — US disclosed
US-20170081340-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS INC (US) 2017-03-23 — — US disclosed
US-9481687-B2 IRAK inhibitors and uses thereof NIMBUS IRIS, INC. (US) 2016-11-01 — — US disclosed
US-9481687-B2 IRAK inhibitors and uses thereof NIMBUS IRIS, INC. (US) 2016-11-01 — — US disclosed
EP-2872144-A1 IRAK INHIBITORS AND USES THEREOF Nimbus Iris, Inc. (US) 2015-05-20 — — EP disclosed
WO-2014194242-A2 FLT3 INHIBITORS AND USES THEREOF NIMBUS IRIS, INC. (US) 2014-12-04 — — WO disclosed
WO-2014011902-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS, INC. (US) 2014-01-16 — — WO disclosed
WO-2014011902-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS, INC. (US) 2014-01-16 — — WO disclosed
US-20140018343-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS, INC. 2014-01-16 — — US disclosed
US-20140018343-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS, INC. 2014-01-16 — — US disclosed
US-20140018343-A1 IRAK INHIBITORS AND USES THEREOF NIMBUS IRIS, INC. 2014-01-16 — — US disclosed
US-6596726-B1 Method of inhibiting epidermal growth factor by treating, with an effective inhibiting amount, a mammal, in need thereof inhibit the epidermal growth factor receptor and related receptors and, in particular, their tyrosine kinase enzyme WARNER LAMBERT COMPANY 2003-07-22 — — US disclosed
EP-0741711-A1 TRICYCLIC COMPOUNDS CAPABLE OF INHIBITING TYROSINE KINASES OF THE EPIDERMAL GROWTH FACTOR RECEPTOR FAMILY WARNER-LAMBERT COMPANY (US) 1996-11-13 — — EP disclosed
WO-1995019970-A1 TRICYCLIC COMPOUNDS CAPABLE OF INHIBITING TYROSINE KINASES OF THE EPIDERMAL GROWTH FACTOR RECEPTOR FAMILY WARNER-LAMBERT COMPANY (US) 1995-07-27 — — 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-20230172057-A1 HETEROCYCLIC COMPOUND CONTAINING HETEROATOM SUBSTITUTED FLUORENE AND OPTOELECTRONIC DEVICE CHRM1, CHRM2, CHRM4 PDE4A 4447/4885PDE4B 4316/4885PDE4C 4322/4885
US-20170081340-A1 IRAK INHIBITORS AND USES THEREOF IRAK4, IRAK2, IRAK1 PDE4A 1146/4885PDE4B 1162/4885PDE4C 1351/4885
US-20140018343-A1 IRAK INHIBITORS AND USES THEREOF IRAK4, IRAK2, IRAK1 PDE4A 1146/4885PDE4B 1162/4885PDE4C 1351/4885

“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.

Send feedback