SCHEMBL989375

SCHEMBL989375

CN1CCN(Cc2cc[c]cc2C(F)(F)F)CC1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
KDM4E B2RXH2 5/20 0.58
POLB P06746 1/20 0.58
NR1H2 P55055 1/20 0.58
ATM Q13315 3/20 0.46
NPSR1 Q6W5P4 3/20 0.44
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 3/20 0.42
GAA P10253 1/20 0.42
KIT P10721 5/20 0.41
CHKA P35790 1/20 0.41
SRC P12931 1/20 0.40
MEN1 O00255 2/20 0.40
RECQL P46063 1/20 0.39
ABL1 P00519 1/20 0.39
MC4R P32245 1/20 0.39

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
SCHEMBL1655534 0.88 ALDH1A1 (0.46) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL27081642 0.86 KDM4E (0.48) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL28001279 0.82 KDM4E (0.42) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL16463965 0.82 CYP2A13 (0.45) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL27677146 0.82 ALDH1A1 (0.52) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL14318329 0.78 ALDH1A1 (0.88) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL28816963 0.76 MLNR (0.42) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL28001612 0.76 MLNR (0.42) ALDH1A1KDM4EPOLBNR1H2ATM
SCHEMBL347003 0.76 DDR1 (0.42) ALDH1A1KDM4EABL1
SCHEMBL7923610 0.75 NR1H2 (0.72) ALDH1A1KDM4EPOLBNR1H2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111777592-B N4- (2, 5-dimethoxyphenyl) -pyrimidinediamine targeted DDR1 inhibitor and preparation and application thereof 温州医科大学 2021-06-18 CN claimed
CN-111793035-B N4- (3-methoxyphenyl) -pyrimidinediamine targeted DDR1 inhibitor and preparation and application thereof 温州医科大学 2021-06-18 CN claimed
US-20240217967-A1 INDOLINE DERIVATIVES AS DDRS INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-07-04 US disclosed
US-20240190847-A1 INDOLINE DERIVATIVES AS DDR1 AND DDR2 INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-06-13 US disclosed
EP-4313292-A1 INDOLINE DERIVATIVES AS DDR1 AND DDR2 INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-02-07 EP disclosed
EP-4313972-A1 INDOLINE DERIVATIVES AS DDRS INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-02-07 EP disclosed
CN-117120434-A Indoline derivatives as DDR1 and DDR2 inhibitors 奇斯药制品公司 2023-11-24 CN disclosed
CN-117062812-A Indoline derivatives as DDR inhibitors 奇斯药制品公司 2023-11-14 CN disclosed
CN-110194772-A For inhibiting (miscellaneous) the fragrant cyclics of the alkynyl of protein kinase activity 深圳市塔吉瑞生物医药有限公司 2019-09-03 CN disclosed
CN-102548987-B Fluoro-substituted compounds as kinase inhibitors and methods of use thereof MEDOLUTION LTD JIANGSU CHINA 2014-04-16 CN disclosed
CN-102548987-A Fluoro-substituted compounds as kinase inhibitors and methods of use thereof MEDOLUTION LTD 2012-07-04 CN disclosed
WO-2011008788-A1 FLUORO-SUBSTITUTED COMPOUNDS AS KINASE INHIBITORS AND METHODS OF USE THEREOF ZHANG DAWEI (US) 2011-01-20 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-20240190847-A1 INDOLINE DERIVATIVES AS DDR1 AND DDR2 INHIBITORS DDR1, DDR2, DDRGK1 ALDH1A1 2364/4885KDM4E 2415/4885POLB 2296/4885
US-20240217967-A1 INDOLINE DERIVATIVES AS DDRS INHIBITORS DDR1, DDR2, DDRGK1 ALDH1A1 3751/4885KDM4E 2592/4885POLB 2234/4885

“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.